N-[2-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-4-ethoxy-benzamide

Systemtic Name: N-[2-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-4-ethoxy-benzamide Openeye Name: N-[2-[2-(3,4-dimethylanilino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-4-ethoxy-benzamide CAS Name: N-[2-[[2-(3,4-dimethylanilino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]-4-ethoxybenzamide IUPAC Name: N-[2-[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-4-ethoxybenzamide Traditional Name: N-[2-[[2-(3,4-dimethylanilino)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]-4-ethoxy-benzamide Formula: C26H25N3O3S2 MolecularWeight: 491.625

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC(=C(C=C4)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC(=C(C=C4)C)C

InChI

InChI=1S/C26H25N3O3S2/c1-4-32-21-10-6-18(7-11-21)25(31)28-20-9-12-22-23(14-20)34-26(29-22)33-15-24(30)27-19-8-5-16(2)17(3)13-19/h5-14H,4,15H2,1-3H3,(H,27,30)(H,28,31)