N-cyclopropyl-2-[[4-(3,4-dimethylphenyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-cyclopropyl-2-[[4-(3,4-dimethylphenyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-cyclopropyl-2-[[4-(3,4-dimethylphenyl)-5-(2-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-cyclopropyl-2-[[4-(3,4-dimethylphenyl)-5-(2-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-cyclopropyl-2-[[4-(3,4-dimethylphenyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-cyclopropyl-2-[[4-(3,4-dimethylphenyl)-5-(2-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=NN=C2SCC(=O)NC3CC3)C4=CC=CC=N4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=NN=C2SCC(=O)NC3CC3)C4=CC=CC=N4)C

InChI

InChI=1S/C20H21N5OS/c1-13-6-9-16(11-14(13)2)25-19(17-5-3-4-10-21-17)23-24-20(25)27-12-18(26)22-15-7-8-15/h3-6,9-11,15H,7-8,12H2,1-2H3,(H,22,26)