[2-(cycloheptylamino)-2-oxidanylidene-ethyl] (2S)-3-phenyl-2-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: [2-(cycloheptylamino)-2-oxidanylidene-ethyl] (2S)-3-phenyl-2-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: [2-(cycloheptylamino)-2-oxo-ethyl] (2S)-3-phenyl-2-(thiophene-2-carbonylamino)propanoate CAS Name: (2S)-2-[[oxo(thiophen-2-yl)methyl]amino]-3-phenylpropanoic acid [2-(cycloheptylamino)-2-oxoethyl] ester IUPAC Name: [2-(cycloheptylamino)-2-oxoethyl] (2S)-3-phenyl-2-(thiophene-2-carbonylamino)propanoate Traditional Name: (2S)-3-phenyl-2-(2-thenoylamino)propionic acid [2-(cycloheptylamino)-2-keto-ethyl] ester Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)COC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

C1CCCC(CC1)NC(=O)COC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C23H28N2O4S/c26-21(24-18-11-6-1-2-7-12-18)16-29-23(28)19(15-17-9-4-3-5-10-17)25-22(27)20-13-8-14-30-20/h3-5,8-10,13-14,18-19H,1-2,6-7,11-12,15-16H2,(H,24,26)(H,25,27)/t19-/m0/s1