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

Systemtic Name: N-[3-(1H-indol-3-yl)-1-[1-(4-methylsulfanylphenyl)ethylamino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[1-(1H-indol-3-ylmethyl)-2-[1-(4-methylsulfanylphenyl)ethylamino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[3-(1H-indol-3-yl)-1-[1-[4-(methylthio)phenyl]ethylamino]-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-(1H-indol-3-yl)-1-[1-(4-methylsulfanylphenyl)ethylamino]-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[1-(1H-indol-3-ylmethyl)-2-keto-2-[1-[4-(methylthio)phenyl]ethylamino]ethyl]thiophene-2-carboxamide Formula: C25H25N3O2S2 MolecularWeight: 463.6149

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O2S2/c1-16(17-9-11-19(31-2)12-10-17)27-24(29)22(28-25(30)23-8-5-13-32-23)14-18-15-26-21-7-4-3-6-20(18)21/h3-13,15-16,22,26H,14H2,1-2H3,(H,27,29)(H,28,30)