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

Systemtic Name: N-[(2S)-1-[(5-tert-butyl-2-methoxy-phenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-(5-tert-butyl-2-methoxy-anilino)-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[(2S)-1-(5-tert-butyl-2-methoxyanilino)-1-oxo-3-phenylpropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-(5-tert-butyl-2-methoxyanilino)-1-oxo-3-phenylpropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-(5-tert-butyl-2-methoxy-anilino)-2-keto-ethyl]thiophene-2-carboxamide Formula: C25H28N2O3S MolecularWeight: 436.56642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C25H28N2O3S/c1-25(2,3)18-12-13-21(30-4)19(16-18)26-23(28)20(15-17-9-6-5-7-10-17)27-24(29)22-11-8-14-31-22/h5-14,16,20H,15H2,1-4H3,(H,26,28)(H,27,29)/t20-/m0/s1