N-(indol-1-ylmethyl)-3-methoxy-N-(2-methylphenyl)sulfonyl-2-[(E)-3-oxidanylidene-3-(propylamino)prop-1-enyl]benzamide

Systemtic Name: N-(indol-1-ylmethyl)-3-methoxy-N-(2-methylphenyl)sulfonyl-2-[(E)-3-oxidanylidene-3-(propylamino)prop-1-enyl]benzamide Openeye Name: N-(indol-1-ylmethyl)-3-methoxy-N-(o-tolylsulfonyl)-2-[(E)-3-oxo-3-(propylamino)prop-1-enyl]benzamide CAS Name: N-(1-indolylmethyl)-3-methoxy-N-(2-methylphenyl)sulfonyl-2-[(E)-3-oxo-3-(propylamino)prop-1-enyl]benzamide IUPAC Name: N-(indol-1-ylmethyl)-3-methoxy-N-(2-methylphenyl)sulfonyl-2-[(E)-3-oxo-3-(propylamino)prop-1-enyl]benzamide Traditional Name: N-(indol-1-ylmethyl)-2-[(E)-3-keto-3-(propylamino)prop-1-enyl]-3-methoxy-N-(o-tolylsulfonyl)benzamide Formula: C30H31N3O5S MolecularWeight: 545.64924

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C=CC1=C(C=CC=C1OC)C(=O)N(CN2C=CC3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4C

Isomeric SMILES

CCCNC(=O)/C=C/C1=C(C=CC=C1OC)C(=O)N(CN2C=CC3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4C

InChI

InChI=1S/C30H31N3O5S/c1-4-19-31-29(34)17-16-24-25(12-9-14-27(24)38-3)30(35)33(39(36,37)28-15-8-5-10-22(28)2)21-32-20-18-23-11-6-7-13-26(23)32/h5-18,20H,4,19,21H2,1-3H3,(H,31,34)/b17-16+