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

Systemtic Name: 3-[2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoylamino]benzamide Openeye Name: 3-[[2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetyl]amino]benzamide CAS Name: 3-[[2-(1,3-benzothiazol-2-ylmethylthio)-1-oxoethyl]amino]benzamide IUPAC Name: 3-[[2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetyl]amino]benzamide Traditional Name: 3-[[2-(1,3-benzothiazol-2-ylmethylthio)acetyl]amino]benzamide Formula: C17H15N3O2S2 MolecularWeight: 357.4499

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CSCC(=O)NC3=CC=CC(=C3)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CSCC(=O)NC3=CC=CC(=C3)C(=O)N

InChI

InChI=1S/C17H15N3O2S2/c18-17(22)11-4-3-5-12(8-11)19-15(21)9-23-10-16-20-13-6-1-2-7-14(13)24-16/h1-8H,9-10H2,(H2,18,22)(H,19,21)