6-[[[3-(1,3-benzothiazol-2-yl)-4-chloranyl-phenyl]amino]methylidene]-2-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[3-(1,3-benzothiazol-2-yl)-4-chloranyl-phenyl]amino]methylidene]-2-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[3-(1,3-benzothiazol-2-yl)-4-chloro-anilino]methylene]-2-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[3-(1,3-benzothiazol-2-yl)-4-chloroanilino]methylidene]-2-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[3-(1,3-benzothiazol-2-yl)-4-chloroanilino]methylidene]-2-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[3-(1,3-benzothiazol-2-yl)-4-chloro-anilino]methylene]-2-methoxy-cyclohexa-2,4-dien-1-one Formula: C21H15ClN2O2S MolecularWeight: 394.874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=CNC2=CC(=C(C=C2)Cl)C3=NC4=CC=CC=C4S3)C1=O

Isomeric SMILES

COC1=CC=CC(=CNC2=CC(=C(C=C2)Cl)C3=NC4=CC=CC=C4S3)C1=O

InChI

InChI=1S/C21H15ClN2O2S/c1-26-18-7-4-5-13(20(18)25)12-23-14-9-10-16(22)15(11-14)21-24-17-6-2-3-8-19(17)27-21/h2-12,23H,1H3