5-(4-methoxyphenyl)-4-(4-methylphenyl)-2-(morpholin-4-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 5-(4-methoxyphenyl)-4-(4-methylphenyl)-2-(morpholin-4-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 5-(4-methoxyphenyl)-2-(morpholinomethyl)-4-(p-tolyl)-1,2,4-triazole-3-thione CAS Name: 5-(4-methoxyphenyl)-4-(4-methylphenyl)-2-(4-morpholinylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 5-(4-methoxyphenyl)-4-(4-methylphenyl)-2-(morpholin-4-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 5-(4-methoxyphenyl)-2-(morpholinomethyl)-4-(p-tolyl)-1,2,4-triazole-3-thione Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O2S/c1-16-3-7-18(8-4-16)25-20(17-5-9-19(26-2)10-6-17)22-24(21(25)28)15-23-11-13-27-14-12-23/h3-10H,11-15H2,1-2H3