3-(4-butylphenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N(CC2=CC=C(C=C2)C)CC3=CC=CC=N3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N(CC2=CC=C(C=C2)C)CC3=CC=CC=N3

InChI

InChI=1S/C25H29N3S/c1-3-4-7-21-13-15-23(16-14-21)27-25(29)28(19-24-8-5-6-17-26-24)18-22-11-9-20(2)10-12-22/h5-6,8-17H,3-4,7,18-19H2,1-2H3,(H,27,29)