N-[3-(1H-indol-3-yl)-1-[2-(4-methylphenyl)sulfanylethylamino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-(1H-indol-3-yl)-1-[2-(4-methylphenyl)sulfanylethylamino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[1-(1H-indol-3-ylmethyl)-2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl]thiophene-2-carboxamide CAS Name: N-[3-(1H-indol-3-yl)-1-[2-[(4-methylphenyl)thio]ethylamino]-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-(1H-indol-3-yl)-1-[2-(4-methylphenyl)sulfanylethylamino]-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[1-(1H-indol-3-ylmethyl)-2-keto-2-[2-(p-tolylthio)ethylamino]ethyl]thiophene-2-carboxamide Formula: C25H25N3O2S2 MolecularWeight: 463.6149

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CS4

InChI

InChI=1S/C25H25N3O2S2/c1-17-8-10-19(11-9-17)31-14-12-26-24(29)22(28-25(30)23-7-4-13-32-23)15-18-16-27-21-6-3-2-5-20(18)21/h2-11,13,16,22,27H,12,14-15H2,1H3,(H,26,29)(H,28,30)