tert-butyl N-[(1R,3S)-3-(1H-benzimidazol-2-ylsulfanylmethyl)cyclopentyl]carbamate

Systemtic Name: tert-butyl N-[(1R,3S)-3-(1H-benzimidazol-2-ylsulfanylmethyl)cyclopentyl]carbamate Openeye Name: tert-butyl N-[(1R,3S)-3-(1H-benzimidazol-2-ylsulfanylmethyl)cyclopentyl]carbamate CAS Name: N-[(1R,3S)-3-[(1H-benzimidazol-2-ylthio)methyl]cyclopentyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1R,3S)-3-(1H-benzimidazol-2-ylsulfanylmethyl)cyclopentyl]carbamate Traditional Name: N-[(1R,3S)-3-[(1H-benzimidazol-2-ylthio)methyl]cyclopentyl]carbamic acid tert-butyl ester Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(C1)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]1CC[C@@H](C1)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C18H25N3O2S/c1-18(2,3)23-17(22)19-13-9-8-12(10-13)11-24-16-20-14-6-4-5-7-15(14)21-16/h4-7,12-13H,8-11H2,1-3H3,(H,19,22)(H,20,21)/t12-,13+/m0/s1