4-[4-(1,3-benzothiazol-2-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-2-methyl-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-(1,3-benzothiazol-2-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-2-methyl-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-(1,3-benzothiazol-2-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-hydroxy-2-methyl-cyclohexa-2,5-dien-1-one CAS Name: 4-[4-(1,3-benzothiazol-2-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-hydroxy-2-methyl-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-(1,3-benzothiazol-2-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-hydroxy-2-methylcyclohexa-2,5-dien-1-one Traditional Name: 4-[4-(1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolin-3-ylidene]-3-hydroxy-2-methyl-cyclohexa-2,5-dien-1-one Formula: C18H15N3O2S MolecularWeight: 337.3956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C(NN2)C)C3=NC4=CC=CC=C4S3)C=CC1=O)O

Isomeric SMILES

CC1=C(C(=C2C(=C(NN2)C)C3=NC4=CC=CC=C4S3)C=CC1=O)O

InChI

InChI=1S/C18H15N3O2S/c1-9-13(22)8-7-11(17(9)23)16-15(10(2)20-21-16)18-19-12-5-3-4-6-14(12)24-18/h3-8,20-21,23H,1-2H3