Name: Name:5-[(1-benzothiophen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Brand: Angene
SKU: AG01AMBD
Rating: 90 (10 reviews)

5-[(1-benzothiophen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

CAS No.:

30125-98-5

Catalog Number:

AG01AMBD

Molecular Formula:

C12H7NOS3

Molecular Weight:

277.3851

Catalog Number:

AG01AMBD

Chemical Name:

5-[(1-benzothiophen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

CAS Number:

30125-98-5

Molecular Formula:

C12H7NOS3

Molecular Weight:

277.3851

MDL Number:

MFCD29033925

IUPAC Name:

(5Z)-5-(1-benzothiophen-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

InChI:

InChI=1S/C12H7NOS3/c14-11-10(17-12(15)13-11)5-7-6-16-9-4-2-1-3-8(7)9/h1-6H,(H,13,14,15)/b10-5-

InChI Key:

RKHVXLKCPTUUBP-YHYXMXQVSA-N

SMILES:

S=C1NC(=O)C(=Cc2csc3c2cccc3)S1

Complexity:

393

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

276.969g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

277.374g/mol

Monoisotopic Mass:

276.969g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

115A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.8