3-[[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonylamino]-2-methyl-benzamide

Systemtic Name: 3-[[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonylamino]-2-methyl-benzamide Openeye Name: 3-[[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]amino]-2-methyl-benzamide CAS Name: 3-[[[4-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-oxomethyl]amino]-2-methylbenzamide IUPAC Name: 3-[[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]amino]-2-methylbenzamide Traditional Name: 3-[[4-[(1,3-benzothiazol-2-ylthio)methyl]benzoyl]amino]-2-methyl-benzamide Formula: C23H19N3O2S2 MolecularWeight: 433.54586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3)C(=O)N

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3)C(=O)N

InChI

InChI=1S/C23H19N3O2S2/c1-14-17(21(24)27)5-4-7-18(14)25-22(28)16-11-9-15(10-12-16)13-29-23-26-19-6-2-3-8-20(19)30-23/h2-12H,13H2,1H3,(H2,24,27)(H,25,28)