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

Systemtic Name: 1-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetyl]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxoethyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetyl]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)CC2=C(N(N=C2C)C3=CC=CC=C3)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)CC2=C(N(N=C2C)C3=CC=CC=C3)C)C

InChI

InChI=1S/C23H27N5OS/c1-5-18-11-9-10-15(2)22(18)24-23(30)26-25-21(29)14-20-16(3)27-28(17(20)4)19-12-7-6-8-13-19/h6-13H,5,14H2,1-4H3,(H,25,29)(H2,24,26,30)