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

Systemtic Name: 3-heptyl-1-[(4-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 3-heptyl-1-(p-tolylmethyl)-1-(2-pyridylmethyl)thiourea CAS Name: 3-heptyl-1-[(4-methylphenyl)methyl]-1-(2-pyridinylmethyl)thiourea IUPAC Name: 3-heptyl-1-[(4-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 3-heptyl-1-(4-methylbenzyl)-1-(2-pyridylmethyl)thiourea Formula: C22H31N3S MolecularWeight: 369.56664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)N(CC1=CC=C(C=C1)C)CC2=CC=CC=N2

Isomeric SMILES

CCCCCCCNC(=S)N(CC1=CC=C(C=C1)C)CC2=CC=CC=N2

InChI

InChI=1S/C22H31N3S/c1-3-4-5-6-8-16-24-22(26)25(18-21-10-7-9-15-23-21)17-20-13-11-19(2)12-14-20/h7,9-15H,3-6,8,16-18H2,1-2H3,(H,24,26)