(5Z)-5-[4-[(2-chlorophenyl)carbonylamino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-3-cyclopropyl-N-ethyl-1H-pyrazole-2-carboxamide

Systemtic Name: (5Z)-5-[4-[(2-chlorophenyl)carbonylamino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-3-cyclopropyl-N-ethyl-1H-pyrazole-2-carboxamide Openeye Name: (5Z)-5-[4-[(2-chlorobenzoyl)amino]-6-oxo-cyclohexa-2,4-dien-1-ylidene]-3-cyclopropyl-N-ethyl-1H-pyrazole-2-carboxamide CAS Name: (5Z)-5-[4-[[(2-chlorophenyl)-oxomethyl]amino]-6-oxo-1-cyclohexa-2,4-dienylidene]-3-cyclopropyl-N-ethyl-1H-pyrazole-2-carboxamide IUPAC Name: (5Z)-5-[4-[(2-chlorobenzoyl)amino]-6-oxocyclohexa-2,4-dien-1-ylidene]-3-cyclopropyl-N-ethyl-1H-pyrazole-2-carboxamide Traditional Name: (3Z)-3-[4-[(2-chlorobenzoyl)amino]-6-keto-cyclohexa-2,4-dien-1-ylidene]-5-cyclopropyl-N-ethyl-3-pyrazoline-1-carboxamide Formula: C22H21ClN4O3 MolecularWeight: 424.88014

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1C(=CC(=C2C=CC(=CC2=O)NC(=O)C3=CC=CC=C3Cl)N1)C4CC4

Isomeric SMILES

CCNC(=O)N1C(=C/C(=C/2\C=CC(=CC2=O)NC(=O)C3=CC=CC=C3Cl)/N1)C4CC4

InChI

InChI=1S/C22H21ClN4O3/c1-2-24-22(30)27-19(13-7-8-13)12-18(26-27)16-10-9-14(11-20(16)28)25-21(29)15-5-3-4-6-17(15)23/h3-6,9-13,26H,2,7-8H2,1H3,(H,24,30)(H,25,29)/b18-16-