1-[1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-[1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-[1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-[1-(1-ethyl-3-methyl-4-pyrazolyl)ethyl]-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-[1-(1-ethyl-3-methylpyrazol-4-yl)ethyl]-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-[1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C16H21N5O3S MolecularWeight: 363.43464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O3S/c1-5-20-9-13(11(3)19-20)10(2)17-16(25)18-14-7-6-12(21(22)23)8-15(14)24-4/h6-10H,5H2,1-4H3,(H2,17,18,25)