1-[(2-ethylpyrazol-3-yl)methyl]-3-(3-nitrophenyl)thiourea

Systemtic Name: 1-[(2-ethylpyrazol-3-yl)methyl]-3-(3-nitrophenyl)thiourea Openeye Name: 1-[(2-ethylpyrazol-3-yl)methyl]-3-(3-nitrophenyl)thiourea CAS Name: 1-[(2-ethyl-3-pyrazolyl)methyl]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-[(2-ethylpyrazol-3-yl)methyl]-3-(3-nitrophenyl)thiourea Traditional Name: 1-[(2-ethylpyrazol-3-yl)methyl]-3-(3-nitrophenyl)thiourea Formula: C13H15N5O2S MolecularWeight: 305.3555

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N5O2S/c1-2-17-12(6-7-15-17)9-14-13(21)16-10-4-3-5-11(8-10)18(19)20/h3-8H,2,9H2,1H3,(H2,14,16,21)