1-(3-methylsulfanylpropyl)-3-(5-nitro-2-oxidanyl-phenyl)thiourea

Systemtic Name: 1-(3-methylsulfanylpropyl)-3-(5-nitro-2-oxidanyl-phenyl)thiourea Openeye Name: 1-(2-hydroxy-5-nitro-phenyl)-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-(2-hydroxy-5-nitrophenyl)-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-(2-hydroxy-5-nitrophenyl)-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-(2-hydroxy-5-nitro-phenyl)-3-[3-(methylthio)propyl]thiourea Formula: C11H15N3O3S2 MolecularWeight: 301.3851

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])O

Isomeric SMILES

CSCCCNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])O

InChI

InChI=1S/C11H15N3O3S2/c1-19-6-2-5-12-11(18)13-9-7-8(14(16)17)3-4-10(9)15/h3-4,7,15H,2,5-6H2,1H3,(H2,12,13,18)