1-[(1,5-dimethylpyrazol-4-yl)methyl]-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-[(1,5-dimethylpyrazol-4-yl)methyl]-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-[(1,5-dimethylpyrazol-4-yl)methyl]-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-[(1,5-dimethyl-4-pyrazolyl)methyl]-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-[(1,5-dimethylpyrazol-4-yl)methyl]-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-[(1,5-dimethylpyrazol-4-yl)methyl]-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C14H17N5O3S MolecularWeight: 335.38148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)CNC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C=NN1C)CNC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C14H17N5O3S/c1-9-10(8-16-18(9)2)7-15-14(23)17-12-5-4-11(19(20)21)6-13(12)22-3/h4-6,8H,7H2,1-3H3,(H2,15,17,23)