N-[(2S)-1-[(3-chloranyl-4-methyl-phenyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-1-[(3-chloranyl-4-methyl-phenyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-2-(3-chloro-4-methyl-anilino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[(2S)-1-(3-chloro-4-methylanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-(3-chloro-4-methylanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-2-(3-chloro-4-methyl-anilino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]thiophene-2-carboxamide Formula: C23H20ClN3O2S MolecularWeight: 437.9418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CS4)Cl

InChI

InChI=1S/C23H20ClN3O2S/c1-14-8-9-16(12-18(14)24)26-22(28)20(27-23(29)21-7-4-10-30-21)11-15-13-25-19-6-3-2-5-17(15)19/h2-10,12-13,20,25H,11H2,1H3,(H,26,28)(H,27,29)/t20-/m0/s1