N-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-3-(2-methylphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-3-(2-methylphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(1,1-dioxo-1,2-benzothiazol-3-yl)-3-(o-tolyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(1,1-dioxo-1,2-benzothiazol-3-yl)-3-(2-methylphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(1,1-dioxo-1,2-benzothiazol-3-yl)-3-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-(1,1-diketo-1,2-benzothiazol-3-yl)-3-(o-tolyl)-1-phenyl-pyrazole-4-carboxamide Formula: C24H18N4O3S MolecularWeight: 442.48972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN(C=C2C(=O)NC3=NS(=O)(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1C2=NN(C=C2C(=O)NC3=NS(=O)(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C24H18N4O3S/c1-16-9-5-6-12-18(16)22-20(15-28(26-22)17-10-3-2-4-11-17)24(29)25-23-19-13-7-8-14-21(19)32(30,31)27-23/h2-15H,1H3,(H,25,27,29)