tert-butyl N-[(2S)-3-methyl-1-(2-oxidanylidene-3H-benzimidazol-1-yl)-1-sulfanylidene-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-3-methyl-1-(2-oxidanylidene-3H-benzimidazol-1-yl)-1-sulfanylidene-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-2-methyl-1-(2-oxo-3H-benzimidazole-1-carbothioyl)propyl]carbamate CAS Name: N-[(2S)-3-methyl-1-(2-oxo-3H-benzimidazol-1-yl)-1-sulfanylidenebutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-3-methyl-1-(2-oxo-3H-benzimidazol-1-yl)-1-sulfanylidenebutan-2-yl]carbamate Traditional Name: N-[(1S)-1-(2-keto-3H-benzimidazole-1-carbothioyl)-2-methyl-propyl]carbamic acid tert-butyl ester Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=S)N1C2=CC=CC=C2NC1=O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=S)N1C2=CC=CC=C2NC1=O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H23N3O3S/c1-10(2)13(19-16(22)23-17(3,4)5)14(24)20-12-9-7-6-8-11(12)18-15(20)21/h6-10,13H,1-5H3,(H,18,21)(H,19,22)/t13-/m0/s1