S-[(6S)-7-(cyclopentylamino)-6-(methoxycarbonylamino)-7-oxidanylidene-heptyl] 2-methylpropanethioate

Systemtic Name: S-[(6S)-7-(cyclopentylamino)-6-(methoxycarbonylamino)-7-oxidanylidene-heptyl] 2-methylpropanethioate Openeye Name: S-[(6S)-7-(cyclopentylamino)-6-(methoxycarbonylamino)-7-oxo-heptyl] 2-methylpropanethioate CAS Name: 2-methylpropanethioic acid S-[(6S)-7-(cyclopentylamino)-6-(methoxycarbonylamino)-7-oxoheptyl] ester IUPAC Name: S-[(6S)-7-(cyclopentylamino)-6-(methoxycarbonylamino)-7-oxoheptyl] 2-methylpropanethioate Traditional Name: 2-methylpropanethioic acid S-[(6S)-6-(carbomethoxyamino)-7-(cyclopentylamino)-7-keto-heptyl] ester Formula: C18H32N2O4S MolecularWeight: 372.52268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)SCCCCCC(C(=O)NC1CCCC1)NC(=O)OC

Isomeric SMILES

CC(C)C(=O)SCCCCC[C@@H](C(=O)NC1CCCC1)NC(=O)OC

InChI

InChI=1S/C18H32N2O4S/c1-13(2)17(22)25-12-8-4-5-11-15(20-18(23)24-3)16(21)19-14-9-6-7-10-14/h13-15H,4-12H2,1-3H3,(H,19,21)(H,20,23)/t15-/m0/s1