N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-(1-cyclopentyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-[(1-cyclopentyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(5-tert-butyl-2-phenylpyrazol-3-yl)-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[(1-cyclopentyltetrazol-5-yl)thio]acetamide Formula: C21H27N7OS MolecularWeight: 425.55038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CSC2=NN=NN2C3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CSC2=NN=NN2C3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H27N7OS/c1-21(2,3)17-13-18(27(24-17)15-9-5-4-6-10-15)22-19(29)14-30-20-23-25-26-28(20)16-11-7-8-12-16/h4-6,9-10,13,16H,7-8,11-12,14H2,1-3H3,(H,22,29)