tert-butyl N-[(E)-N-(4-methylphenyl)sulfonyl-C-pyrazol-1-yl-carbonimidoyl]carbamate

Systemtic Name: tert-butyl N-[(E)-N-(4-methylphenyl)sulfonyl-C-pyrazol-1-yl-carbonimidoyl]carbamate Openeye Name: tert-butyl N-[(E)-N-(p-tolylsulfonyl)-C-pyrazol-1-yl-carbonimidoyl]carbamate CAS Name: N-[(E)-(4-methylphenyl)sulfonylimino-(1-pyrazolyl)methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-N-(4-methylphenyl)sulfonyl-C-pyrazol-1-ylcarbonimidoyl]carbamate Traditional Name: N-[(E)-C-pyrazol-1-yl-N-tosyl-carbonimidoyl]carbamic acid tert-butyl ester Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C(\NC(=O)OC(C)(C)C)/N2C=CC=N2

InChI

InChI=1S/C16H20N4O4S/c1-12-6-8-13(9-7-12)25(22,23)19-14(20-11-5-10-17-20)18-15(21)24-16(2,3)4/h5-11H,1-4H3,(H,18,19,21)