1-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-3-(3-ethanoylphenyl)urea

Systemtic Name: 1-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-3-(3-ethanoylphenyl)urea Openeye Name: 1-(3-acetylphenyl)-3-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]urea CAS Name: 1-(3-acetylphenyl)-3-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]amino]urea IUPAC Name: 1-(3-acetylphenyl)-3-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]urea Traditional Name: 1-(3-acetylphenyl)-3-[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]urea Formula: C18H16N4O3S2 MolecularWeight: 400.47464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)NNC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)NNC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H16N4O3S2/c1-11(23)12-5-4-6-13(9-12)19-17(25)22-21-16(24)10-26-18-20-14-7-2-3-8-15(14)27-18/h2-9H,10H2,1H3,(H,21,24)(H2,19,22,25)