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

Systemtic Name: 5-(4-chlorophenyl)-4-methyl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 5-(4-chlorophenyl)-4-methyl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione CAS Name: 5-(4-chlorophenyl)-4-methyl-2-(1-pyrrolidinylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 5-(4-chlorophenyl)-4-methyl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 5-(4-chlorophenyl)-4-methyl-2-(pyrrolidinomethyl)-1,2,4-triazole-3-thione Formula: C14H17ClN4S MolecularWeight: 308.82958

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCCC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCCC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H17ClN4S/c1-17-13(11-4-6-12(15)7-5-11)16-19(14(17)20)10-18-8-2-3-9-18/h4-7H,2-3,8-10H2,1H3