1-(3,5-dimethoxyphenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea

Systemtic Name: 1-(3,5-dimethoxyphenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea Openeye Name: 1-(3,5-dimethoxyphenyl)-3-[1-(1-naphthylmethyl)pyrazol-4-yl]thiourea CAS Name: 1-(3,5-dimethoxyphenyl)-3-[1-(1-naphthalenylmethyl)-4-pyrazolyl]thiourea IUPAC Name: 1-(3,5-dimethoxyphenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea Traditional Name: 1-(3,5-dimethoxyphenyl)-3-[1-(1-naphthylmethyl)pyrazol-4-yl]thiourea Formula: C23H22N4O2S MolecularWeight: 418.51138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=S)NC2=CN(N=C2)CC3=CC=CC4=CC=CC=C43)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=S)NC2=CN(N=C2)CC3=CC=CC4=CC=CC=C43)OC

InChI

InChI=1S/C23H22N4O2S/c1-28-20-10-18(11-21(12-20)29-2)25-23(30)26-19-13-24-27(15-19)14-17-8-5-7-16-6-3-4-9-22(16)17/h3-13,15H,14H2,1-2H3,(H2,25,26,30)