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

Systemtic Name: 1-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-[(1-benzyl-3,5-dimethyl-pyrazole-4-carbonyl)amino]-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[(1-benzyl-3,5-dimethylpyrazole-4-carbonyl)amino]-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[(1-benzyl-3,5-dimethyl-pyrazole-4-carbonyl)amino]-3-p-anisyl-thiourea Formula: C22H25N5O2S MolecularWeight: 423.5312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NNC(=S)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NNC(=S)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25N5O2S/c1-15-20(16(2)27(26-15)14-18-7-5-4-6-8-18)21(28)24-25-22(30)23-13-17-9-11-19(29-3)12-10-17/h4-12H,13-14H2,1-3H3,(H,24,28)(H2,23,25,30)