1-[1-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]benzotriazol-4-yl]-N,N-dimethyl-ethanamine

Systemtic Name: 1-[1-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]benzotriazol-4-yl]-N,N-dimethyl-ethanamine Openeye Name: 1-[1-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]benzotriazol-4-yl]-N,N-dimethyl-ethanamine CAS Name: 1-[1-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-benzotriazolyl]-N,N-dimethylethanamine IUPAC Name: 1-[1-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]benzotriazol-4-yl]-N,N-dimethylethanamine Traditional Name: 1-[1-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]benzotriazol-4-yl]ethyl-dimethyl-amine Formula: C21H26N6S MolecularWeight: 394.53634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C2C(=CC=C1)N(N=N2)C(CCSC)C3=NC4=CC=CC=C4N3)N(C)C

Isomeric SMILES

CC(C1=C2C(=CC=C1)N(N=N2)C(CCSC)C3=NC4=CC=CC=C4N3)N(C)C

InChI

InChI=1S/C21H26N6S/c1-14(26(2)3)15-8-7-11-18-20(15)24-25-27(18)19(12-13-28-4)21-22-16-9-5-6-10-17(16)23-21/h5-11,14,19H,12-13H2,1-4H3,(H,22,23)