N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2H-benzotriazole-5-carboxamide Traditional Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2H-benzotriazole-5-carboxamide Formula: C18H18N6OS MolecularWeight: 366.44012

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=NNN=C4C=C3

Isomeric SMILES

CSCC[C@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=NNN=C4C=C3

InChI

InChI=1S/C18H18N6OS/c1-26-9-8-15(17-19-12-4-2-3-5-13(12)20-17)21-18(25)11-6-7-14-16(10-11)23-24-22-14/h2-7,10,15H,8-9H2,1H3,(H,19,20)(H,21,25)(H,22,23,24)/t15-/m1/s1