3-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-1,1-bis(phenylmethyl)thiourea

Systemtic Name: 3-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-1,1-bis(phenylmethyl)thiourea Openeye Name: 1,1-dibenzyl-3-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]thiourea CAS Name: 3-[1-[(4-chlorophenyl)methyl]-4-pyrazolyl]-1,1-bis(phenylmethyl)thiourea IUPAC Name: 1,1-dibenzyl-3-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]thiourea Traditional Name: 1,1-dibenzyl-3-[1-(4-chlorobenzyl)pyrazol-4-yl]thiourea Formula: C25H23ClN4S MolecularWeight: 446.99492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)NC3=CN(N=C3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)NC3=CN(N=C3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H23ClN4S/c26-23-13-11-22(12-14-23)18-30-19-24(15-27-30)28-25(31)29(16-20-7-3-1-4-8-20)17-21-9-5-2-6-10-21/h1-15,19H,16-18H2,(H,28,31)