2-(3,4-dimethylphenyl)-4-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(3,4-dimethylphenyl)-4-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]isoquinoline-1,3-dione Openeye Name: 2-(3,4-dimethylphenyl)-4-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylene]isoquinoline-1,3-dione CAS Name: 2-(3,4-dimethylphenyl)-4-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(3,4-dimethylphenyl)-4-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]isoquinoline-1,3-dione Traditional Name: 2-(3,4-dimethylphenyl)-4-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylene]isoquinoline-1,3-quinone Formula: C26H21N3O2S MolecularWeight: 439.52884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC=C3C4=CC=CC=C4C(=O)N(C3=O)C5=CC(=C(C=C5)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC=C3C4=CC=CC=C4C(=O)N(C3=O)C5=CC(=C(C=C5)C)C

InChI

InChI=1S/C26H21N3O2S/c1-15-8-11-22-23(12-15)32-26(28-22)27-14-21-19-6-4-5-7-20(19)24(30)29(25(21)31)18-10-9-16(2)17(3)13-18/h4-14H,1-3H3,(H,27,28)