tert-butyl N-[(2R)-1-(dipentylamino)-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-1-(dipentylamino)-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-1-(benzylsulfanylmethyl)-2-(dipentylamino)-2-oxo-ethyl]carbamate CAS Name: N-[(2R)-1-(dipentylamino)-1-oxo-3-(phenylmethylthio)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-3-benzylsulfanyl-1-(dipentylamino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1R)-1-[(benzylthio)methyl]-2-(diamylamino)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C25H42N2O3S MolecularWeight: 450.67758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=O)C(CSCC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCN(CCCCC)C(=O)[C@H](CSCC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H42N2O3S/c1-6-8-13-17-27(18-14-9-7-2)23(28)22(26-24(29)30-25(3,4)5)20-31-19-21-15-11-10-12-16-21/h10-12,15-16,22H,6-9,13-14,17-20H2,1-5H3,(H,26,29)/t22-/m0/s1