2-[2-[(E)-4-(dimethylamino)-4-oxidanylidene-but-1-enyl]-1-propyl-indol-3-yl]-3-methoxy-N-methyl-N-(2-methylphenyl)sulfonyl-benzamide

Systemtic Name: 2-[2-[(E)-4-(dimethylamino)-4-oxidanylidene-but-1-enyl]-1-propyl-indol-3-yl]-3-methoxy-N-methyl-N-(2-methylphenyl)sulfonyl-benzamide Openeye Name: 2-[2-[(E)-4-(dimethylamino)-4-oxo-but-1-enyl]-1-propyl-indol-3-yl]-3-methoxy-N-methyl-N-(o-tolylsulfonyl)benzamide CAS Name: 2-[2-[(E)-4-(dimethylamino)-4-oxobut-1-enyl]-1-propyl-3-indolyl]-3-methoxy-N-methyl-N-(2-methylphenyl)sulfonylbenzamide IUPAC Name: 2-[2-[(E)-4-(dimethylamino)-4-oxobut-1-enyl]-1-propylindol-3-yl]-3-methoxy-N-methyl-N-(2-methylphenyl)sulfonylbenzamide Traditional Name: 2-[2-[(E)-4-(dimethylamino)-4-keto-but-1-enyl]-1-propyl-indol-3-yl]-3-methoxy-N-methyl-N-(o-tolylsulfonyl)benzamide Formula: C33H37N3O5S MolecularWeight: 587.72898

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(=C1C=CCC(=O)N(C)C)C3=C(C=CC=C3OC)C(=O)N(C)S(=O)(=O)C4=CC=CC=C4C

Isomeric SMILES

CCCN1C2=CC=CC=C2C(=C1/C=C/CC(=O)N(C)C)C3=C(C=CC=C3OC)C(=O)N(C)S(=O)(=O)C4=CC=CC=C4C

InChI

InChI=1S/C33H37N3O5S/c1-7-22-36-26-17-10-9-15-24(26)31(27(36)18-13-21-30(37)34(3)4)32-25(16-12-19-28(32)41-6)33(38)35(5)42(39,40)29-20-11-8-14-23(29)2/h8-20H,7,21-22H2,1-6H3/b18-13+