4-ethyl-5-(4-methoxyphenyl)-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 4-ethyl-5-(4-methoxyphenyl)-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-ethyl-5-(4-methoxyphenyl)-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione CAS Name: 4-ethyl-5-(4-methoxyphenyl)-2-(1-pyrrolidinylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-ethyl-5-(4-methoxyphenyl)-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 4-ethyl-5-(4-methoxyphenyl)-2-(pyrrolidinomethyl)-1,2,4-triazole-3-thione Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCCC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCCC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C16H22N4OS/c1-3-19-15(13-6-8-14(21-2)9-7-13)17-20(16(19)22)12-18-10-4-5-11-18/h6-9H,3-5,10-12H2,1-2H3