S-[(6S)-7-(tert-butylamino)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-7-oxidanylidene-heptyl] ethanethioate

Systemtic Name: S-[(6S)-7-(tert-butylamino)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-7-oxidanylidene-heptyl] ethanethioate Openeye Name: S-[(6S)-6-(tert-butoxycarbonylamino)-7-(tert-butylamino)-7-oxo-heptyl] ethanethioate CAS Name: ethanethioic acid S-[(6S)-7-(tert-butylamino)-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-7-oxoheptyl] ester IUPAC Name: S-[(6S)-7-(tert-butylamino)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-7-oxoheptyl] ethanethioate Traditional Name: ethanethioic acid S-[(6S)-6-(tert-butoxycarbonylamino)-7-(tert-butylamino)-7-keto-heptyl] ester Formula: C18H34N2O4S MolecularWeight: 374.53856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H34N2O4S/c1-13(21)25-12-10-8-9-11-14(15(22)20-17(2,3)4)19-16(23)24-18(5,6)7/h14H,8-12H2,1-7H3,(H,19,23)(H,20,22)/t14-/m0/s1