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

Systemtic Name: 3-(4-butylphenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-(4-butylphenyl)-1-(p-tolylmethyl)-1-(4-pyridylmethyl)thiourea CAS Name: 3-(4-butylphenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 3-(4-butylphenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 3-(4-butylphenyl)-1-(4-methylbenzyl)-1-(4-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=NC=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N(CC2=CC=C(C=C2)C)CC3=CC=NC=C3

InChI

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