3-(3,3-dimethoxypropylsulfanyl)-N-(4-methylphenyl)-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-(3,3-dimethoxypropylsulfanyl)-N-(4-methylphenyl)-1H-1,2,4-triazol-5-amine Openeye Name: 3-(3,3-dimethoxypropylsulfanyl)-N-(p-tolyl)-1H-1,2,4-triazol-5-amine CAS Name: 3-(3,3-dimethoxypropylthio)-N-(4-methylphenyl)-1H-1,2,4-triazol-5-amine IUPAC Name: 3-(3,3-dimethoxypropylsulfanyl)-N-(4-methylphenyl)-1H-1,2,4-triazol-5-amine Traditional Name: [3-(3,3-dimethoxypropylthio)-1H-1,2,4-triazol-5-yl]-(p-tolyl)amine Formula: C14H20N4O2S MolecularWeight: 308.3992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NN2)SCCC(OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NN2)SCCC(OC)OC

InChI

InChI=1S/C14H20N4O2S/c1-10-4-6-11(7-5-10)15-13-16-14(18-17-13)21-9-8-12(19-2)20-3/h4-7,12H,8-9H2,1-3H3,(H2,15,16,17,18)