5-(4-chlorophenyl)-4-(2-methylphenyl)-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 5-(4-chlorophenyl)-4-(2-methylphenyl)-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 5-(4-chlorophenyl)-4-(o-tolyl)-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione CAS Name: 5-(4-chlorophenyl)-4-(2-methylphenyl)-2-(1-pyrrolidinylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 5-(4-chlorophenyl)-4-(2-methylphenyl)-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 5-(4-chlorophenyl)-4-(o-tolyl)-2-(pyrrolidinomethyl)-1,2,4-triazole-3-thione Formula: C20H21ClN4S MolecularWeight: 384.92554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN(C2=S)CN3CCCC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN(C2=S)CN3CCCC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H21ClN4S/c1-15-6-2-3-7-18(15)25-19(16-8-10-17(21)11-9-16)22-24(20(25)26)14-23-12-4-5-13-23/h2-3,6-11H,4-5,12-14H2,1H3