tert-butyl N-[(2S)-5-methyl-1-(2-oxidanylidene-3H-benzimidazol-1-yl)-1-sulfanylidene-hexan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-5-methyl-1-(2-oxidanylidene-3H-benzimidazol-1-yl)-1-sulfanylidene-hexan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-4-methyl-1-(2-oxo-3H-benzimidazole-1-carbothioyl)pentyl]carbamate CAS Name: N-[(2S)-5-methyl-1-(2-oxo-3H-benzimidazol-1-yl)-1-sulfanylidenehexan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-5-methyl-1-(2-oxo-3H-benzimidazol-1-yl)-1-sulfanylidenehexan-2-yl]carbamate Traditional Name: N-[(1S)-1-(2-keto-3H-benzimidazole-1-carbothioyl)-4-methyl-pentyl]carbamic acid tert-butyl ester Formula: C19H27N3O3S MolecularWeight: 377.50098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O3S/c1-12(2)10-11-14(21-18(24)25-19(3,4)5)16(26)22-15-9-7-6-8-13(15)20-17(22)23/h6-9,12,14H,10-11H2,1-5H3,(H,20,23)(H,21,24)/t14-/m0/s1