1-(4-azanyl-3-nitro-phenyl)-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-(4-azanyl-3-nitro-phenyl)-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-(4-amino-3-nitro-phenyl)-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-(4-amino-3-nitrophenyl)-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-(4-amino-3-nitrophenyl)-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-(4-amino-3-nitro-phenyl)-3-[3-(methylthio)propyl]thiourea Formula: C11H16N4O2S2 MolecularWeight: 300.40034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N4O2S2/c1-19-6-2-5-13-11(18)14-8-3-4-9(12)10(7-8)15(16)17/h3-4,7H,2,5-6,12H2,1H3,(H2,13,14,18)