3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(3-methyl-2-oxo-benzimidazol-1-yl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-(3-methyl-2-oxo-1-benzimidazolyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(3-methyl-2-oxobenzimidazol-1-yl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-(2-keto-3-methyl-benzimidazol-1-yl)-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]propionamide Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCC(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCC(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C21H22N6O2/c1-25-18-4-2-3-5-19(18)27(21(25)29)11-10-20(28)23-12-16-6-8-17(9-7-16)13-26-15-22-14-24-26/h2-9,14-15H,10-13H2,1H3,(H,23,28)