ethyl 2-[cyclopentyl-[(1-ethanoylsulfanyl-3-phenyl-propyl)carbamoyl]amino]ethanoate

Systemtic Name: ethyl 2-[cyclopentyl-[(1-ethanoylsulfanyl-3-phenyl-propyl)carbamoyl]amino]ethanoate Openeye Name: ethyl 2-[(1-acetylsulfanyl-3-phenyl-propyl)carbamoyl-cyclopentyl-amino]acetate CAS Name: 2-[[[[1-(acetylthio)-3-phenylpropyl]amino]-oxomethyl]-cyclopentylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1-acetylsulfanyl-3-phenylpropyl)carbamoyl-cyclopentylamino]acetate Traditional Name: 2-[[1-(acetylthio)-3-phenyl-propyl]carbamoyl-cyclopentyl-amino]acetic acid ethyl ester Formula: C21H30N2O4S MolecularWeight: 406.5389

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1CCCC1)C(=O)NC(CCC2=CC=CC=C2)SC(=O)C

Isomeric SMILES

CCOC(=O)CN(C1CCCC1)C(=O)NC(CCC2=CC=CC=C2)SC(=O)C

InChI

InChI=1S/C21H30N2O4S/c1-3-27-20(25)15-23(18-11-7-8-12-18)21(26)22-19(28-16(2)24)14-13-17-9-5-4-6-10-17/h4-6,9-10,18-19H,3,7-8,11-15H2,1-2H3,(H,22,26)