1-[5-azanyl-3-(4-chlorophenyl)-1-(phenylmethyl)pyrazol-4-yl]-3-(cyclohexylmethyl)urea

Systemtic Name: 1-[5-azanyl-3-(4-chlorophenyl)-1-(phenylmethyl)pyrazol-4-yl]-3-(cyclohexylmethyl)urea Openeye Name: 1-[5-amino-1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-3-(cyclohexylmethyl)urea CAS Name: 1-[5-amino-3-(4-chlorophenyl)-1-(phenylmethyl)-4-pyrazolyl]-3-(cyclohexylmethyl)urea IUPAC Name: 1-[5-amino-1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-3-(cyclohexylmethyl)urea Traditional Name: 1-[5-amino-1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-3-(cyclohexylmethyl)urea Formula: C24H28ClN5O MolecularWeight: 437.96502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)NC2=C(N(N=C2C3=CC=C(C=C3)Cl)CC4=CC=CC=C4)N

Isomeric SMILES

C1CCC(CC1)CNC(=O)NC2=C(N(N=C2C3=CC=C(C=C3)Cl)CC4=CC=CC=C4)N

InChI

InChI=1S/C24H28ClN5O/c25-20-13-11-19(12-14-20)21-22(28-24(31)27-15-17-7-3-1-4-8-17)23(26)30(29-21)16-18-9-5-2-6-10-18/h2,5-6,9-14,17H,1,3-4,7-8,15-16,26H2,(H2,27,28,31)