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

Systemtic Name: 4-decoxy-N-[2-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-decoxy-N-[2-[2-(2,6-dimethylanilino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-decoxy-N-[2-[[2-(2,6-dimethylanilino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-decoxy-N-[2-[2-(2,6-dimethylanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-decoxy-N-[2-[[2-(2,6-dimethylanilino)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]benzamide Formula: C34H41N3O3S2 MolecularWeight: 603.83764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=C(C=CC=C4C)C

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=C(C=CC=C4C)C

InChI

InChI=1S/C34H41N3O3S2/c1-4-5-6-7-8-9-10-11-21-40-28-18-15-26(16-19-28)33(39)35-27-17-20-29-30(22-27)42-34(36-29)41-23-31(38)37-32-24(2)13-12-14-25(32)3/h12-20,22H,4-11,21,23H2,1-3H3,(H,35,39)(H,37,38)