N-[(2S)-1-[(5-tert-butyl-2-oxidanyl-phenyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-1-[(5-tert-butyl-2-oxidanyl-phenyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-2-(5-tert-butyl-2-hydroxy-anilino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[(2S)-1-(5-tert-butyl-2-hydroxyanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-(5-tert-butyl-2-hydroxyanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-2-(5-tert-butyl-2-hydroxy-anilino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]thiophene-2-carboxamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27N3O3S/c1-26(2,3)17-10-11-22(30)20(14-17)28-24(31)21(29-25(32)23-9-6-12-33-23)13-16-15-27-19-8-5-4-7-18(16)19/h4-12,14-15,21,27,30H,13H2,1-3H3,(H,28,31)(H,29,32)/t21-/m0/s1