phenyl N-[[4-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]carbamoyl]sulfamate

Systemtic Name: phenyl N-[[4-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]carbamoyl]sulfamate Openeye Name: phenyl N-[[4-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]carbamoyl]sulfamate CAS Name: N-[[4-[3-methyl-5-(trifluoromethyl)-1-pyrazolyl]anilino]-oxomethyl]sulfamic acid phenyl ester IUPAC Name: phenyl N-[[4-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]carbamoyl]sulfamate Traditional Name: N-[[4-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]carbamoyl]sulfamic acid phenyl ester Formula: C18H15F3N4O4S MolecularWeight: 440.39631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(F)(F)F)C2=CC=C(C=C2)NC(=O)NS(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1)C(F)(F)F)C2=CC=C(C=C2)NC(=O)NS(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C18H15F3N4O4S/c1-12-11-16(18(19,20)21)25(23-12)14-9-7-13(8-10-14)22-17(26)24-30(27,28)29-15-5-3-2-4-6-15/h2-11H,1H3,(H2,22,24,26)