(3S)-N-(2,4-dimethylphenyl)-3-(1,2,4-triazol-1-yl)butanamide

Systemtic Name: (3S)-N-(2,4-dimethylphenyl)-3-(1,2,4-triazol-1-yl)butanamide Openeye Name: (3S)-N-(2,4-dimethylphenyl)-3-(1,2,4-triazol-1-yl)butanamide CAS Name: (3S)-N-(2,4-dimethylphenyl)-3-(1,2,4-triazol-1-yl)butanamide IUPAC Name: (3S)-N-(2,4-dimethylphenyl)-3-(1,2,4-triazol-1-yl)butanamide Traditional Name: (3S)-N-(2,4-dimethylphenyl)-3-(1,2,4-triazol-1-yl)butyramide Formula: C14H18N4O MolecularWeight: 258.31892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CC(C)N2C=NC=N2)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C[C@H](C)N2C=NC=N2)C

InChI

InChI=1S/C14H18N4O/c1-10-4-5-13(11(2)6-10)17-14(19)7-12(3)18-9-15-8-16-18/h4-6,8-9,12H,7H2,1-3H3,(H,17,19)/t12-/m0/s1