N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-3H-benzimidazole-5-carboxamide Openeye Name: N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-3H-benzimidazole-5-carboxamide CAS Name: N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-3H-benzimidazole-5-carboxamide Formula: C18H16N6O MolecularWeight: 332.35924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=CC4=C(C=C3)N=CN4

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=CC4=C(C=C3)N=CN4

InChI

InChI=1S/C18H16N6O/c1-12(13-2-5-15(6-3-13)24-11-19-9-22-24)23-18(25)14-4-7-16-17(8-14)21-10-20-16/h2-12H,1H3,(H,20,21)(H,23,25)/t12-/m0/s1