1-(2,5-dimethoxyphenyl)-3-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]thiourea

Systemtic Name: 1-(2,5-dimethoxyphenyl)-3-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]thiourea Openeye Name: 1-[1-(2-benzyloxyethyl)pyrazol-4-yl]-3-(2,5-dimethoxyphenyl)thiourea CAS Name: 1-(2,5-dimethoxyphenyl)-3-[1-(2-phenylmethoxyethyl)-4-pyrazolyl]thiourea IUPAC Name: 1-(2,5-dimethoxyphenyl)-3-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]thiourea Traditional Name: 1-[1-(2-benzoxyethyl)pyrazol-4-yl]-3-(2,5-dimethoxyphenyl)thiourea Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=S)NC2=CN(N=C2)CCOCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=S)NC2=CN(N=C2)CCOCC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O3S/c1-26-18-8-9-20(27-2)19(12-18)24-21(29)23-17-13-22-25(14-17)10-11-28-15-16-6-4-3-5-7-16/h3-9,12-14H,10-11,15H2,1-2H3,(H2,23,24,29)