3-(1,3-benzothiazol-2-yl)-N-(3,4-dimethylphenyl)-4-(3-methoxyphenyl)but-3-enamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-(3,4-dimethylphenyl)-4-(3-methoxyphenyl)but-3-enamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-(3,4-dimethylphenyl)-4-(3-methoxyphenyl)but-3-enamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-(3,4-dimethylphenyl)-4-(3-methoxyphenyl)-3-butenamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-(3,4-dimethylphenyl)-4-(3-methoxyphenyl)but-3-enamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-(3,4-dimethylphenyl)-4-(3-methoxyphenyl)but-3-enamide Formula: C26H24N2O2S MolecularWeight: 428.54596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC(=CC2=CC(=CC=C2)OC)C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC(=CC2=CC(=CC=C2)OC)C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C26H24N2O2S/c1-17-11-12-21(13-18(17)2)27-25(29)16-20(14-19-7-6-8-22(15-19)30-3)26-28-23-9-4-5-10-24(23)31-26/h4-15H,16H2,1-3H3,(H,27,29)