4-ethoxy-N-[(2S)-1-oxidanylidene-3-phenyl-1-phenylazanyl-propan-2-yl]-1-(sulfanylmethyl)cyclohexane-1-carboxamide

Systemtic Name: 4-ethoxy-N-[(2S)-1-oxidanylidene-3-phenyl-1-phenylazanyl-propan-2-yl]-1-(sulfanylmethyl)cyclohexane-1-carboxamide Openeye Name: N-[(1S)-2-anilino-1-benzyl-2-oxo-ethyl]-4-ethoxy-1-(sulfanylmethyl)cyclohexanecarboxamide CAS Name: N-[(2S)-1-anilino-1-oxo-3-phenylpropan-2-yl]-4-ethoxy-1-(mercaptomethyl)-1-cyclohexanecarboxamide IUPAC Name: N-[(2S)-1-anilino-1-oxo-3-phenylpropan-2-yl]-4-ethoxy-1-(sulfanylmethyl)cyclohexane-1-carboxamide Traditional Name: N-[(1S)-2-anilino-1-benzyl-2-keto-ethyl]-4-ethoxy-1-(mercaptomethyl)cyclohexanecarboxamide Formula: C25H32N2O3S MolecularWeight: 440.59818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CCC(CC1)(CS)C(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC1CCC(CC1)(CS)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C25H32N2O3S/c1-2-30-21-13-15-25(18-31,16-14-21)24(29)27-22(17-19-9-5-3-6-10-19)23(28)26-20-11-7-4-8-12-20/h3-12,21-22,31H,2,13-18H2,1H3,(H,26,28)(H,27,29)/t21?,22-,25?/m0/s1