1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[(3,5-dimethyl-1-phenyl-pyrazole-4-carbonyl)amino]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[[(3,5-dimethyl-1-phenyl-4-pyrazolyl)-oxomethyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[(3,5-dimethyl-1-phenylpyrazole-4-carbonyl)amino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-[(3,5-dimethyl-1-phenyl-pyrazole-4-carbonyl)amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C)C

InChI

InChI=1S/C22H25N5OS/c1-5-17-11-9-10-14(2)20(17)23-22(29)25-24-21(28)19-15(3)26-27(16(19)4)18-12-7-6-8-13-18/h6-13H,5H2,1-4H3,(H,24,28)(H2,23,25,29)