Catalog Number:
AG008TCN
Chemical Name:
4SC-202
CAS Number:
1186222-89-8
Molecular Formula:
C30H29N5O6S2
Molecular Weight:
619.7112
MDL Number:
MFCD25976779
IUPAC Name:
(E)-N-(2-aminophenyl)-3-[1-[4-(1-methylpyrazol-4-yl)phenyl]sulfonylpyrrol-3-yl]prop-2-enamide;4-methylbenzenesulfonic acid
InChI:
InChI=1S/C23H21N5O3S.C7H8O3S/c1-27-16-19(14-25-27)18-7-9-20(10-8-18)32(30,31)28-13-12-17(15-28)6-11-23(29)26-22-5-3-2-4-21(22)24;1-6-2-4-7(5-3-6)11(8,9)10/h2-16H,24H2,1H3,(H,26,29);2-5H,1H3,(H,8,9,10)/b11-6+;
InChI Key:
IAVXAZDVNICKFJ-ICSBZGNSSA-N
SMILES:
O=C(Nc1ccccc1N)/C=C/c1ccn(c1)S(=O)(=O)c1ccc(cc1)c1cnn(c1)C.Cc1ccc(cc1)S(=O)(=O)O
