1-(2-ethylphenyl)-3-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]thiourea

Systemtic Name: 1-(2-ethylphenyl)-3-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]thiourea Openeye Name: 1-(2-ethylphenyl)-3-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]thiourea CAS Name: 1-(2-ethylphenyl)-3-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-4-pyrazolyl]thiourea IUPAC Name: 1-(2-ethylphenyl)-3-[1-[(3-methoxyphenyl)methyl]-3,5-dimethylpyrazol-4-yl]thiourea Traditional Name: 1-(2-ethylphenyl)-3-(1-m-anisyl-3,5-dimethyl-pyrazol-4-yl)thiourea Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NC2=C(N(N=C2C)CC3=CC(=CC=C3)OC)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NC2=C(N(N=C2C)CC3=CC(=CC=C3)OC)C

InChI

InChI=1S/C22H26N4OS/c1-5-18-10-6-7-12-20(18)23-22(28)24-21-15(2)25-26(16(21)3)14-17-9-8-11-19(13-17)27-4/h6-13H,5,14H2,1-4H3,(H2,23,24,28)