4-[2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoylamino]-N-(4-methoxyphenyl)benzamide

Systemtic Name: 4-[2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoylamino]-N-(4-methoxyphenyl)benzamide Openeye Name: 4-[[2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide CAS Name: 4-[[2-(1,3-benzothiazol-2-ylmethylthio)-1-oxoethyl]amino]-N-(4-methoxyphenyl)benzamide IUPAC Name: 4-[[2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide Traditional Name: 4-[[2-(1,3-benzothiazol-2-ylmethylthio)acetyl]amino]-N-(4-methoxyphenyl)benzamide Formula: C24H21N3O3S2 MolecularWeight: 463.57184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CSCC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CSCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H21N3O3S2/c1-30-19-12-10-18(11-13-19)26-24(29)16-6-8-17(9-7-16)25-22(28)14-31-15-23-27-20-4-2-3-5-21(20)32-23/h2-13H,14-15H2,1H3,(H,25,28)(H,26,29)