1-(2,3-dihydro-1H-inden-2-yl)-3-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]thiourea

Systemtic Name: 1-(2,3-dihydro-1H-inden-2-yl)-3-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]thiourea Openeye Name: 1-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]-3-indan-2-yl-thiourea CAS Name: 1-(2,3-dihydro-1H-inden-2-yl)-3-[1-[(2,3-dimethoxyphenyl)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-(2,3-dihydro-1H-inden-2-yl)-3-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]thiourea Traditional Name: 1-indan-2-yl-3-(1-o-veratrylpyrazol-4-yl)thiourea Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN2C=C(C=N2)NC(=S)NC3CC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=CC(=C1OC)CN2C=C(C=N2)NC(=S)NC3CC4=CC=CC=C4C3

InChI

InChI=1S/C22H24N4O2S/c1-27-20-9-5-8-17(21(20)28-2)13-26-14-19(12-23-26)25-22(29)24-18-10-15-6-3-4-7-16(15)11-18/h3-9,12,14,18H,10-11,13H2,1-2H3,(H2,24,25,29)