tert-butyl N-[(1R,3S)-3-[[(4-methylsulfanylphenyl)sulfonylamino]methyl]cyclopentyl]carbamate

Systemtic Name: tert-butyl N-[(1R,3S)-3-[[(4-methylsulfanylphenyl)sulfonylamino]methyl]cyclopentyl]carbamate Openeye Name: tert-butyl N-[(1R,3S)-3-[[(4-methylsulfanylphenyl)sulfonylamino]methyl]cyclopentyl]carbamate CAS Name: N-[(1R,3S)-3-[[[4-(methylthio)phenyl]sulfonylamino]methyl]cyclopentyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1R,3S)-3-[[(4-methylsulfanylphenyl)sulfonylamino]methyl]cyclopentyl]carbamate Traditional Name: N-[(1R,3S)-3-[[[4-(methylthio)phenyl]sulfonylamino]methyl]cyclopentyl]carbamic acid tert-butyl ester Formula: C18H28N2O4S2 MolecularWeight: 400.55592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(C1)CNS(=O)(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]1CC[C@@H](C1)CNS(=O)(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C18H28N2O4S2/c1-18(2,3)24-17(21)20-14-6-5-13(11-14)12-19-26(22,23)16-9-7-15(25-4)8-10-16/h7-10,13-14,19H,5-6,11-12H2,1-4H3,(H,20,21)/t13-,14+/m0/s1