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

Systemtic Name: 4-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]methylidene]-2-(4-morpholin-4-ylsulfonylphenyl)isoquinoline-1,3-dione Openeye Name: 4-[[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]methylene]-2-(4-morpholinosulfonylphenyl)isoquinoline-1,3-dione CAS Name: 4-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]methylidene]-2-[4-(4-morpholinylsulfonyl)phenyl]isoquinoline-1,3-dione IUPAC Name: 4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]methylidene]-2-(4-morpholin-4-ylsulfonylphenyl)isoquinoline-1,3-dione Traditional Name: 4-[[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]methylene]-2-(4-morpholinosulfonylphenyl)isoquinoline-1,3-quinone Formula: C31H29N5O6S MolecularWeight: 599.65686

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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)N(C3=O)C5=CC=C(C=C5)S(=O)(=O)N6CCOCC6

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC=C3C4=CC=CC=C4C(=O)N(C3=O)C5=CC=C(C=C5)S(=O)(=O)N6CCOCC6

InChI

InChI=1S/C31H29N5O6S/c1-21-28(31(39)36(33(21)2)23-8-4-3-5-9-23)32-20-27-25-10-6-7-11-26(25)29(37)35(30(27)38)22-12-14-24(15-13-22)43(40,41)34-16-18-42-19-17-34/h3-15,20,32H,16-19H2,1-2H3