N-[4-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3,5-dimethoxy-benzamide

Systemtic Name: N-[4-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3,5-dimethoxy-benzamide Openeye Name: N-[4-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-cyclohexa-1,5-dien-1-yl]-3,5-dimethoxy-benzamide CAS Name: N-[4-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-1-cyclohexa-1,5-dienyl]-3,5-dimethoxybenzamide IUPAC Name: N-[4-(3H-1,3-benzothiazol-2-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]-3,5-dimethoxybenzamide Traditional Name: N-[4-(3H-1,3-benzothiazol-2-ylidene)-3-keto-cyclohexa-1,5-dien-1-yl]-3,5-dimethoxy-benzamide Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NC2=CC(=O)C(=C3NC4=CC=CC=C4S3)C=C2)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NC2=CC(=O)C(=C3NC4=CC=CC=C4S3)C=C2)OC

InChI

InChI=1S/C22H18N2O4S/c1-27-15-9-13(10-16(12-15)28-2)21(26)23-14-7-8-17(19(25)11-14)22-24-18-5-3-4-6-20(18)29-22/h3-12,24H,1-2H3,(H,23,26)