1-[1-(4-cyanobutyl)pyrazol-4-yl]-3-[(3,4-dichlorophenyl)methyl]urea

Systemtic Name: 1-[1-(4-cyanobutyl)pyrazol-4-yl]-3-[(3,4-dichlorophenyl)methyl]urea Openeye Name: 1-[1-(4-cyanobutyl)pyrazol-4-yl]-3-[(3,4-dichlorophenyl)methyl]urea CAS Name: 1-[1-(4-cyanobutyl)-4-pyrazolyl]-3-[(3,4-dichlorophenyl)methyl]urea IUPAC Name: 1-[1-(4-cyanobutyl)pyrazol-4-yl]-3-[(3,4-dichlorophenyl)methyl]urea Traditional Name: 1-[1-(4-cyanobutyl)pyrazol-4-yl]-3-(3,4-dichlorobenzyl)urea Formula: C16H17Cl2N5O MolecularWeight: 366.24508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC(=O)NC2=CN(N=C2)CCCCC#N)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CNC(=O)NC2=CN(N=C2)CCCCC#N)Cl)Cl

InChI

InChI=1S/C16H17Cl2N5O/c17-14-5-4-12(8-15(14)18)9-20-16(24)22-13-10-21-23(11-13)7-3-1-2-6-19/h4-5,8,10-11H,1-3,7,9H2,(H2,20,22,24)