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

Systemtic Name: 4-methyl-N-[2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-methyl-N-[2-[2-(2-methylanilino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-methyl-N-[2-[[2-(2-methylanilino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-methyl-N-[2-[2-(2-methylanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Traditional Name: N-[2-[[2-keto-2-(o-toluidino)ethyl]thio]-1,3-benzothiazol-6-yl]-4-methyl-benzamide Formula: C24H21N3O2S2 MolecularWeight: 447.57244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC=CC=C4C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC=CC=C4C

InChI

InChI=1S/C24H21N3O2S2/c1-15-7-9-17(10-8-15)23(29)25-18-11-12-20-21(13-18)31-24(27-20)30-14-22(28)26-19-6-4-3-5-16(19)2/h3-13H,14H2,1-2H3,(H,25,29)(H,26,28)