1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(3-nitrophenyl)thiourea

Systemtic Name: 1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(3-nitrophenyl)thiourea Openeye Name: 1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(3-nitrophenyl)thiourea CAS Name: 1-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-3-(3-nitrophenyl)thiourea Traditional Name: 1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(3-nitrophenyl)thiourea Formula: C15H19N5O2S MolecularWeight: 333.40866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N5O2S/c1-4-19-11(3)14(10(2)18-19)9-16-15(23)17-12-6-5-7-13(8-12)20(21)22/h5-8H,4,9H2,1-3H3,(H2,16,17,23)