[(1R,2R,3S,4S)-3-acetamido-2-methylsulfanyl-4-(phenylcarbamoyloxy)cyclopentyl] ethanoate

Systemtic Name: [(1R,2R,3S,4S)-3-acetamido-2-methylsulfanyl-4-(phenylcarbamoyloxy)cyclopentyl] ethanoate Openeye Name: [(1R,2R,3S,4S)-3-acetamido-2-methylsulfanyl-4-(phenylcarbamoyloxy)cyclopentyl] acetate CAS Name: acetic acid [(1R,2R,3S,4S)-3-acetamido-4-[anilino(oxo)methoxy]-2-(methylthio)cyclopentyl] ester IUPAC Name: [(1R,2R,3S,4S)-3-acetamido-2-methylsulfanyl-4-(phenylcarbamoyloxy)cyclopentyl] acetate Traditional Name: acetic acid [(1R,2R,3S,4S)-3-acetamido-2-(methylthio)-4-(phenylcarbamoyloxy)cyclopentyl] ester Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CC(C1SC)OC(=O)C)OC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(=O)N[C@H]1[C@H](C[C@H]([C@@H]1SC)OC(=O)C)OC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O5S/c1-10(20)18-15-13(9-14(16(15)25-3)23-11(2)21)24-17(22)19-12-7-5-4-6-8-12/h4-8,13-16H,9H2,1-3H3,(H,18,20)(H,19,22)/t13-,14+,15-,16-/m0/s1