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

Systemtic Name: 3-(2-methoxy-4-nitro-phenyl)-1-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea Openeye Name: 3-(2-methoxy-4-nitro-phenyl)-1-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea CAS Name: 3-(2-methoxy-4-nitrophenyl)-1-methyl-1-[(1,3,5-trimethyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 3-(2-methoxy-4-nitrophenyl)-1-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea Traditional Name: 3-(2-methoxy-4-nitro-phenyl)-1-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea Formula: C16H21N5O3S MolecularWeight: 363.43464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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