1-(2-nitroimidazol-1-yl)-4-phenylsulfanyl-butan-2-ol

Systemtic Name: 1-(2-nitroimidazol-1-yl)-4-phenylsulfanyl-butan-2-ol Openeye Name: 1-(2-nitroimidazol-1-yl)-4-phenylsulfanyl-butan-2-ol CAS Name: 1-(2-nitro-1-imidazolyl)-4-(phenylthio)-2-butanol IUPAC Name: 1-(2-nitroimidazol-1-yl)-4-phenylsulfanylbutan-2-ol Traditional Name: 1-(2-nitroimidazol-1-yl)-4-(phenylthio)butan-2-ol Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(CN2C=CN=C2[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)SCCC(CN2C=CN=C2[N+](=O)[O-])O

InChI

InChI=1S/C13H15N3O3S/c17-11(6-9-20-12-4-2-1-3-5-12)10-15-8-7-14-13(15)16(18)19/h1-5,7-8,11,17H,6,9-10H2