1-(1-ethylpyrazol-3-yl)-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-(1-ethylpyrazol-3-yl)-3-(4-nitrophenyl)thiourea Openeye Name: 1-(1-ethylpyrazol-3-yl)-3-(4-nitrophenyl)thiourea CAS Name: 1-(1-ethyl-3-pyrazolyl)-3-(4-nitrophenyl)thiourea IUPAC Name: 1-(1-ethylpyrazol-3-yl)-3-(4-nitrophenyl)thiourea Traditional Name: 1-(1-ethylpyrazol-3-yl)-3-(4-nitrophenyl)thiourea Formula: C12H13N5O2S MolecularWeight: 291.32892

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCN1C=CC(=N1)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O2S/c1-2-16-8-7-11(15-16)14-12(20)13-9-3-5-10(6-4-9)17(18)19/h3-8H,2H2,1H3,(H2,13,14,15,20)