N-[(E)-3-[2-(1H-indol-3-yl)ethylamino]-1-(4-methylsulfanylphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(E)-3-[2-(1H-indol-3-yl)ethylamino]-1-(4-methylsulfanylphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[(E)-1-[2-(1H-indol-3-yl)ethylcarbamoyl]-2-(4-methylsulfanylphenyl)vinyl]benzamide CAS Name: N-[(E)-3-[2-(1H-indol-3-yl)ethylamino]-1-[4-(methylthio)phenyl]-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(E)-3-[2-(1H-indol-3-yl)ethylamino]-1-(4-methylsulfanylphenyl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(E)-1-[2-(1H-indol-3-yl)ethylcarbamoyl]-2-[4-(methylthio)phenyl]vinyl]benzamide Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C(C(=O)NCCC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C(\C(=O)NCCC2=CNC3=CC=CC=C32)/NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O2S/c1-33-22-13-11-19(12-14-22)17-25(30-26(31)20-7-3-2-4-8-20)27(32)28-16-15-21-18-29-24-10-6-5-9-23(21)24/h2-14,17-18,29H,15-16H2,1H3,(H,28,32)(H,30,31)/b25-17+