4-(2,4-dimethylphenyl)-2-(morpholin-4-ylmethyl)-5-pyridin-3-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-(2,4-dimethylphenyl)-2-(morpholin-4-ylmethyl)-5-pyridin-3-yl-1,2,4-triazole-3-thione Openeye Name: 4-(2,4-dimethylphenyl)-2-(morpholinomethyl)-5-(3-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-(2,4-dimethylphenyl)-2-(4-morpholinylmethyl)-5-(3-pyridinyl)-1,2,4-triazole-3-thione IUPAC Name: 4-(2,4-dimethylphenyl)-2-(morpholin-4-ylmethyl)-5-pyridin-3-yl-1,2,4-triazole-3-thione Traditional Name: 4-(2,4-dimethylphenyl)-2-(morpholinomethyl)-5-(3-pyridyl)-1,2,4-triazole-3-thione Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=NN(C2=S)CN3CCOCC3)C4=CN=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NN(C2=S)CN3CCOCC3)C4=CN=CC=C4)C

InChI

InChI=1S/C20H23N5OS/c1-15-5-6-18(16(2)12-15)25-19(17-4-3-7-21-13-17)22-24(20(25)27)14-23-8-10-26-11-9-23/h3-7,12-13H,8-11,14H2,1-2H3