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

Systemtic Name: 3-[1-[(4-methylphenyl)methyl]pyrazol-3-yl]-1,1-bis(phenylmethyl)thiourea Openeye Name: 1,1-dibenzyl-3-[1-(p-tolylmethyl)pyrazol-3-yl]thiourea CAS Name: 3-[1-[(4-methylphenyl)methyl]-3-pyrazolyl]-1,1-bis(phenylmethyl)thiourea IUPAC Name: 1,1-dibenzyl-3-[1-[(4-methylphenyl)methyl]pyrazol-3-yl]thiourea Traditional Name: 1,1-dibenzyl-3-[1-(4-methylbenzyl)pyrazol-3-yl]thiourea Formula: C26H26N4S MolecularWeight: 426.57644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=CC(=N2)NC(=S)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=CC(=N2)NC(=S)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H26N4S/c1-21-12-14-24(15-13-21)20-30-17-16-25(28-30)27-26(31)29(18-22-8-4-2-5-9-22)19-23-10-6-3-7-11-23/h2-17H,18-20H2,1H3,(H,27,28,31)