5-(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-1,2-dihydropyrazole-3-carboxamide

Systemtic Name: 5-(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-1,2-dihydropyrazole-3-carboxamide Openeye Name: 5-(3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)-N-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]-1,2-dihydropyrazole-3-carboxamide CAS Name: 5-(3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)-N-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-1,2-dihydropyrazole-3-carboxamide IUPAC Name: 5-(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-1,2-dihydropyrazole-3-carboxamide Traditional Name: 5-(3-chloro-6-keto-cyclohexa-2,4-dien-1-ylidene)-N-[4-(4-methylpiperidino)sulfonylphenyl]-3-pyrazoline-3-carboxamide Formula: C22H23ClN4O4S MolecularWeight: 474.96042

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C4C=C(C=CC4=O)Cl)NN3

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C4C=C(C=CC4=O)Cl)NN3

InChI

InChI=1S/C22H23ClN4O4S/c1-14-8-10-27(11-9-14)32(30,31)17-5-3-16(4-6-17)24-22(29)20-13-19(25-26-20)18-12-15(23)2-7-21(18)28/h2-7,12-14,25-26H,8-11H2,1H3,(H,24,29)