2-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-5-methyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]isoindole-1,3-dione

Systemtic Name: 2-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-5-methyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]isoindole-1,3-dione Openeye Name: 2-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-5-methyl-4-oxo-cyclohexa-1,5-dien-1-yl]isoindoline-1,3-dione CAS Name: 2-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-5-methyl-4-oxo-1-cyclohexa-1,5-dienyl]isoindole-1,3-dione IUPAC Name: 2-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-5-methyl-4-oxocyclohexa-1,5-dien-1-yl]isoindole-1,3-dione Traditional Name: 2-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-keto-5-methyl-cyclohexa-1,5-dien-1-yl]isoindoline-1,3-quinone Formula: C22H14N2O3S MolecularWeight: 386.42316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C2NC3=CC=CC=C3S2)C1=O)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC(=C/C(=C/2\NC3=CC=CC=C3S2)/C1=O)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C22H14N2O3S/c1-12-10-13(24-21(26)14-6-2-3-7-15(14)22(24)27)11-16(19(12)25)20-23-17-8-4-5-9-18(17)28-20/h2-11,23H,1H3/b20-16-