2-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 2-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 2-[2-(3,4-dimethoxyanilino)-2-oxo-ethyl]sulfanyl-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 2-[[2-(3,4-dimethoxyanilino)-2-oxoethyl]thio]-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfanyl-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 2-[[2-(3,4-dimethoxyanilino)-2-keto-ethyl]thio]-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide Formula: C25H23N3O4S2 MolecularWeight: 493.59782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC=CC=C3SCC(=O)NC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC=CC=C3SCC(=O)NC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H23N3O4S2/c1-15-7-6-10-21-23(15)27-25(34-21)28-24(30)17-8-4-5-9-20(17)33-14-22(29)26-16-11-12-18(31-2)19(13-16)32-3/h4-13H,14H2,1-3H3,(H,26,29)(H,27,28,30)