Name: Name:3-methyl-3-(methylsulfanyl)-2-oxo-2,3-dihydro-1H-indole-7-carbonitrile
Brand: Angene
SKU: AG01C3LD
Rating: 90 (10 reviews)

3-methyl-3-(methylsulfanyl)-2-oxo-2,3-dihydro-1H-indole-7-carbonitrile

CAS No.:

1955515-72-6

Catalog Number:

AG01C3LD

Molecular Formula:

C11H10N2OS

Molecular Weight:

218.2749

Catalog Number:

AG01C3LD

Chemical Name:

3-methyl-3-(methylsulfanyl)-2-oxo-2,3-dihydro-1H-indole-7-carbonitrile

CAS Number:

1955515-72-6

Molecular Formula:

C11H10N2OS

Molecular Weight:

218.2749

MDL Number:

MFCD29991288

IUPAC Name:

3-methyl-3-methylsulfanyl-2-oxo-1H-indole-7-carbonitrile

InChI:

InChI=1S/C11H10N2OS/c1-11(15-2)8-5-3-4-7(6-12)9(8)13-10(11)14/h3-5H,1-2H3,(H,13,14)

InChI Key:

DTSJJPWAFBMZRB-UHFFFAOYSA-N

SMILES:

CSC1(C)C(=O)Nc2c1cccc2C#N

Complexity:

335

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

218.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

218.274g/mol

Monoisotopic Mass:

218.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5