(6E)-6-[4-(1,3-benzothiazol-2-yl)-1,2-dihydropyrazol-3-ylidene]-4-ethyl-3-oxidanyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[4-(1,3-benzothiazol-2-yl)-1,2-dihydropyrazol-3-ylidene]-4-ethyl-3-oxidanyl-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[4-(1,3-benzothiazol-2-yl)-1,2-dihydropyrazol-3-ylidene]-4-ethyl-3-hydroxy-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[4-(1,3-benzothiazol-2-yl)-1,2-dihydropyrazol-3-ylidene]-4-ethyl-3-hydroxy-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[4-(1,3-benzothiazol-2-yl)-1,2-dihydropyrazol-3-ylidene]-4-ethyl-3-hydroxycyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[4-(1,3-benzothiazol-2-yl)-3-pyrazolin-3-ylidene]-4-ethyl-3-hydroxy-cyclohexa-2,4-dien-1-one Formula: C18H15N3O2S MolecularWeight: 337.3956

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C2C(=CNN2)C3=NC4=CC=CC=C4S3)C(=O)C=C1O

Isomeric SMILES

CCC1=C/C(=C\2/C(=CNN2)C3=NC4=CC=CC=C4S3)/C(=O)C=C1O

InChI

InChI=1S/C18H15N3O2S/c1-2-10-7-11(15(23)8-14(10)22)17-12(9-19-21-17)18-20-13-5-3-4-6-16(13)24-18/h3-9,19,21-22H,2H2,1H3/b17-11+