methyl N-[6-(cyclohexylmethylsulfanyl)-1H-benzimidazol-2-yl]carbamate

Systemtic Name: methyl N-[6-(cyclohexylmethylsulfanyl)-1H-benzimidazol-2-yl]carbamate Openeye Name: methyl N-[6-(cyclohexylmethylsulfanyl)-1H-benzimidazol-2-yl]carbamate CAS Name: N-[6-(cyclohexylmethylthio)-1H-benzimidazol-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[6-(cyclohexylmethylsulfanyl)-1H-benzimidazol-2-yl]carbamate Traditional Name: N-[6-(cyclohexylmethylthio)-1H-benzimidazol-2-yl]carbamic acid methyl ester Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=NC2=C(N1)C=C(C=C2)SCC3CCCCC3

Isomeric SMILES

COC(=O)NC1=NC2=C(N1)C=C(C=C2)SCC3CCCCC3

InChI

InChI=1S/C16H21N3O2S/c1-21-16(20)19-15-17-13-8-7-12(9-14(13)18-15)22-10-11-5-3-2-4-6-11/h7-9,11H,2-6,10H2,1H3,(H2,17,18,19,20)