3-(4-tert-butylphenyl)-N,N-dimethyl-5-methylsulfanyl-1,2,4-triazole-1-carboxamide

Systemtic Name: 3-(4-tert-butylphenyl)-N,N-dimethyl-5-methylsulfanyl-1,2,4-triazole-1-carboxamide Openeye Name: 3-(4-tert-butylphenyl)-N,N-dimethyl-5-methylsulfanyl-1,2,4-triazole-1-carboxamide CAS Name: 3-(4-tert-butylphenyl)-N,N-dimethyl-5-(methylthio)-1,2,4-triazole-1-carboxamide IUPAC Name: 3-(4-tert-butylphenyl)-N,N-dimethyl-5-methylsulfanyl-1,2,4-triazole-1-carboxamide Traditional Name: 3-(4-tert-butylphenyl)-N,N-dimethyl-5-(methylthio)-1,2,4-triazole-1-carboxamide Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN(C(=N2)SC)C(=O)N(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN(C(=N2)SC)C(=O)N(C)C

InChI

InChI=1S/C16H22N4OS/c1-16(2,3)12-9-7-11(8-10-12)13-17-14(22-6)20(18-13)15(21)19(4)5/h7-10H,1-6H3