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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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