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

Systemtic Name: N-tert-butyl-2-[[4-(3,5-dimethylphenyl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]methyl-methyl-amino]ethanamide Openeye Name: N-tert-butyl-2-[[4-(3,5-dimethylphenyl)-5-thioxo-tetrazol-1-yl]methyl-methyl-amino]acetamide CAS Name: N-tert-butyl-2-[[4-(3,5-dimethylphenyl)-5-sulfanylidene-1-tetrazolyl]methyl-methylamino]acetamide IUPAC Name: N-tert-butyl-2-[[4-(3,5-dimethylphenyl)-5-sulfanylidenetetrazol-1-yl]methyl-methylamino]acetamide Traditional Name: N-tert-butyl-2-[[4-(3,5-dimethylphenyl)-5-thioxo-tetrazol-1-yl]methyl-methyl-amino]acetamide Formula: C17H26N6OS MolecularWeight: 362.49294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N6OS/c1-12-7-13(2)9-14(8-12)23-16(25)22(19-20-23)11-21(6)10-15(24)18-17(3,4)5/h7-9H,10-11H2,1-6H3,(H,18,24)