1-(4-azanyl-3-nitro-phenyl)-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-(4-azanyl-3-nitro-phenyl)-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-(4-amino-3-nitro-phenyl)-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-(4-amino-3-nitrophenyl)-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-(4-amino-3-nitrophenyl)-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-(4-amino-3-nitro-phenyl)-3-(tetrahydrofurfuryl)thiourea Formula: C12H16N4O3S MolecularWeight: 296.34544

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NC2=CC(=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CNC(=S)NC2=CC(=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O3S/c13-10-4-3-8(6-11(10)16(17)18)15-12(20)14-7-9-2-1-5-19-9/h3-4,6,9H,1-2,5,7,13H2,(H2,14,15,20)