N-cyclopropyl-2-[[4-(3,4-dimethylphenyl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]methyl-methyl-amino]ethanamide

Systemtic Name: N-cyclopropyl-2-[[4-(3,4-dimethylphenyl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]methyl-methyl-amino]ethanamide Openeye Name: N-cyclopropyl-2-[[4-(3,4-dimethylphenyl)-5-thioxo-tetrazol-1-yl]methyl-methyl-amino]acetamide CAS Name: N-cyclopropyl-2-[[4-(3,4-dimethylphenyl)-5-sulfanylidene-1-tetrazolyl]methyl-methylamino]acetamide IUPAC Name: N-cyclopropyl-2-[[4-(3,4-dimethylphenyl)-5-sulfanylidenetetrazol-1-yl]methyl-methylamino]acetamide Traditional Name: N-cyclopropyl-2-[[4-(3,4-dimethylphenyl)-5-thioxo-tetrazol-1-yl]methyl-methyl-amino]acetamide Formula: C16H22N6OS MolecularWeight: 346.45048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=S)N(N=N2)CN(C)CC(=O)NC3CC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=S)N(N=N2)CN(C)CC(=O)NC3CC3)C

InChI

InChI=1S/C16H22N6OS/c1-11-4-7-14(8-12(11)2)22-16(24)21(18-19-22)10-20(3)9-15(23)17-13-5-6-13/h4,7-8,13H,5-6,9-10H2,1-3H3,(H,17,23)