2-[(4-azanyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,3-dimethylphenyl)propanamide

Systemtic Name: 2-[(4-azanyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,3-dimethylphenyl)propanamide Openeye Name: 2-[(4-amino-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,3-dimethylphenyl)propanamide CAS Name: 2-[(4-amino-5-propan-2-yl-1,2,4-triazol-3-yl)thio]-N-(2,3-dimethylphenyl)propanamide IUPAC Name: 2-[(4-amino-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,3-dimethylphenyl)propanamide Traditional Name: 2-[(4-amino-5-isopropyl-1,2,4-triazol-3-yl)thio]-N-(2,3-dimethylphenyl)propionamide Formula: C16H23N5OS MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C(C)SC2=NN=C(N2N)C(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C(C)SC2=NN=C(N2N)C(C)C)C

InChI

InChI=1S/C16H23N5OS/c1-9(2)14-19-20-16(21(14)17)23-12(5)15(22)18-13-8-6-7-10(3)11(13)4/h6-9,12H,17H2,1-5H3,(H,18,22)