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

Systemtic Name: 1-(5-nitro-2-oxidanyl-phenyl)-3-propyl-thiourea Openeye Name: 1-(2-hydroxy-5-nitro-phenyl)-3-propyl-thiourea CAS Name: 1-(2-hydroxy-5-nitrophenyl)-3-propylthiourea IUPAC Name: 1-(2-hydroxy-5-nitrophenyl)-3-propylthiourea Traditional Name: 1-(2-hydroxy-5-nitro-phenyl)-3-propyl-thiourea Formula: C10H13N3O3S MolecularWeight: 255.29352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13N3O3S/c1-2-5-11-10(17)12-8-6-7(13(15)16)3-4-9(8)14/h3-4,6,14H,2,5H2,1H3,(H2,11,12,17)