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

Systemtic Name: 1-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]-3-(2-methoxy-5-methyl-phenyl)thiourea Openeye Name: 1-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]-3-(2-methoxy-5-methyl-phenyl)thiourea CAS Name: 1-[1-[(2,3-dimethoxyphenyl)methyl]-4-pyrazolyl]-3-(2-methoxy-5-methylphenyl)thiourea IUPAC Name: 1-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]-3-(2-methoxy-5-methylphenyl)thiourea Traditional Name: 1-(2-methoxy-5-methyl-phenyl)-3-(1-o-veratrylpyrazol-4-yl)thiourea Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)NC2=CN(N=C2)CC3=C(C(=CC=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)NC2=CN(N=C2)CC3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C21H24N4O3S/c1-14-8-9-18(26-2)17(10-14)24-21(29)23-16-11-22-25(13-16)12-15-6-5-7-19(27-3)20(15)28-4/h5-11,13H,12H2,1-4H3,(H2,23,24,29)