3-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-1-oxidanyl-1-propan-2-yl-urea

Systemtic Name: 3-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-1-oxidanyl-1-propan-2-yl-urea Openeye Name: 3-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-1-hydroxy-1-isopropyl-urea CAS Name: 3-[2-(1,3-benzothiazol-2-ylthio)ethyl]-1-hydroxy-1-propan-2-ylurea IUPAC Name: 3-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-1-hydroxy-1-propan-2-ylurea Traditional Name: 3-[2-(1,3-benzothiazol-2-ylthio)ethyl]-1-hydroxy-1-isopropyl-urea Formula: C13H17N3O2S2 MolecularWeight: 311.42298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(=O)NCCSC1=NC2=CC=CC=C2S1)O

Isomeric SMILES

CC(C)N(C(=O)NCCSC1=NC2=CC=CC=C2S1)O

InChI

InChI=1S/C13H17N3O2S2/c1-9(2)16(18)12(17)14-7-8-19-13-15-10-5-3-4-6-11(10)20-13/h3-6,9,18H,7-8H2,1-2H3,(H,14,17)