4-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]methylidene]isoquinoline-1,3-dione

Systemtic Name: 4-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]methylidene]isoquinoline-1,3-dione Openeye Name: 4-[[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]methylene]isoquinoline-1,3-dione CAS Name: 4-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]methylidene]isoquinoline-1,3-dione IUPAC Name: 4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]methylidene]isoquinoline-1,3-dione Traditional Name: 4-[[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]methylene]isoquinoline-1,3-quinone Formula: C21H18N4O3 MolecularWeight: 374.39262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC=C3C4=CC=CC=C4C(=O)NC3=O

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC=C3C4=CC=CC=C4C(=O)NC3=O

InChI

InChI=1S/C21H18N4O3/c1-13-18(21(28)25(24(13)2)14-8-4-3-5-9-14)22-12-17-15-10-6-7-11-16(15)19(26)23-20(17)27/h3-12,22H,1-2H3,(H,23,26,27)