2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]ethanamide

Systemtic Name: 2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]ethanamide Openeye Name: 2-(1-tert-butyltetrazol-5-yl)sulfanyl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide CAS Name: 2-[(1-tert-butyl-5-tetrazolyl)thio]-N-methyl-N-[(1-phenyl-4-pyrazolyl)methyl]acetamide IUPAC Name: 2-(1-tert-butyltetrazol-5-yl)sulfanyl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide Traditional Name: 2-[(1-tert-butyltetrazol-5-yl)thio]-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide Formula: C18H23N7OS MolecularWeight: 385.48652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)SCC(=O)N(C)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)SCC(=O)N(C)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H23N7OS/c1-18(2,3)25-17(20-21-22-25)27-13-16(26)23(4)11-14-10-19-24(12-14)15-8-6-5-7-9-15/h5-10,12H,11,13H2,1-4H3