3-methyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide

Systemtic Name: 3-methyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Openeye Name: 3-methyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide CAS Name: 3-methyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide IUPAC Name: 3-methyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Traditional Name: 3-methyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Formula: C18H18N4O MolecularWeight: 306.36172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C)C2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](C)C2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C18H18N4O/c1-13-4-3-5-16(10-13)18(23)21-14(2)15-6-8-17(9-7-15)22-12-19-11-20-22/h3-12,14H,1-2H3,(H,21,23)/t14-/m0/s1