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

Systemtic Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3,4-dimethyl-benzamide Openeye Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]-3,4-dimethyl-benzamide CAS Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]-3,4-dimethylbenzamide IUPAC Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]-3,4-dimethylbenzamide Traditional Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]-3,4-dimethyl-benzamide Formula: C22H18N2O2S MolecularWeight: 374.45552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C3NC4=CC=CC=C4S3)C(=O)C=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C/C(=C/3\NC4=CC=CC=C4S3)/C(=O)C=C2)C

InChI

InChI=1S/C22H18N2O2S/c1-13-7-8-15(11-14(13)2)21(26)23-16-9-10-19(25)17(12-16)22-24-18-5-3-4-6-20(18)27-22/h3-12,24H,1-2H3,(H,23,26)/b22-17-