1-methyl-3-[3-[5-(phenylsulfonylsulfanyl)-1,2,3,4-tetrazol-1-yl]phenyl]urea

Systemtic Name: 1-methyl-3-[3-[5-(phenylsulfonylsulfanyl)-1,2,3,4-tetrazol-1-yl]phenyl]urea Openeye Name: 1-[3-[5-(benzenesulfonylsulfanyl)tetrazol-1-yl]phenyl]-3-methyl-urea CAS Name: 1-[3-[5-(benzenesulfonylthio)-1-tetrazolyl]phenyl]-3-methylurea IUPAC Name: 1-[3-[5-(benzenesulfonylsulfanyl)tetrazol-1-yl]phenyl]-3-methylurea Traditional Name: 1-[3-[5-(besylthio)tetrazol-1-yl]phenyl]-3-methyl-urea Formula: C15H14N6O3S2 MolecularWeight: 390.44006

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=CC=CC(=C1)N2C(=NN=N2)SS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)NC1=CC=CC(=C1)N2C(=NN=N2)SS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C15H14N6O3S2/c1-16-14(22)17-11-6-5-7-12(10-11)21-15(18-19-20-21)25-26(23,24)13-8-3-2-4-9-13/h2-10H,1H3,(H2,16,17,22)