3-(2,6-diethylphenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)thiourea

Systemtic Name: 3-(2,6-diethylphenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 3-(2,6-diethylphenyl)-1-(p-tolylmethyl)-1-(2-pyridylmethyl)thiourea CAS Name: 3-(2,6-diethylphenyl)-1-[(4-methylphenyl)methyl]-1-(2-pyridinylmethyl)thiourea IUPAC Name: 3-(2,6-diethylphenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 3-(2,6-diethylphenyl)-1-(4-methylbenzyl)-1-(2-pyridylmethyl)thiourea Formula: C25H29N3S MolecularWeight: 403.58286

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N(CC2=CC=C(C=C2)C)CC3=CC=CC=N3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N(CC2=CC=C(C=C2)C)CC3=CC=CC=N3

InChI

InChI=1S/C25H29N3S/c1-4-21-9-8-10-22(5-2)24(21)27-25(29)28(18-23-11-6-7-16-26-23)17-20-14-12-19(3)13-15-20/h6-16H,4-5,17-18H2,1-3H3,(H,27,29)