1-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]thiourea

Systemtic Name: 1-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]thiourea Openeye Name: [1-[(4-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]thiourea CAS Name: [1-[(4-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]thiourea IUPAC Name: [1-[(4-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]thiourea Traditional Name: [1-(4-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]thiourea Formula: C13H15ClN4S MolecularWeight: 294.803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)Cl)C)NC(=S)N

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)Cl)C)NC(=S)N

InChI

InChI=1S/C13H15ClN4S/c1-8-12(16-13(15)19)9(2)18(17-8)7-10-3-5-11(14)6-4-10/h3-6H,7H2,1-2H3,(H3,15,16,19)