1-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-3-[3-(2-methylphenyl)decan-5-yl]urea

Systemtic Name: 1-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-3-[3-(2-methylphenyl)decan-5-yl]urea Openeye Name: 1-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]-3-[1-[2-(o-tolyl)butyl]hexyl]urea CAS Name: 1-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]-3-[3-(2-methylphenyl)decan-5-yl]urea IUPAC Name: 1-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-3-[3-(2-methylphenyl)decan-5-yl]urea Traditional Name: 1-[6-methyl-2,4-bis(methylthio)-3-pyridyl]-3-[1-[2-(o-tolyl)butyl]hexyl]urea Formula: C26H39N3OS2 MolecularWeight: 473.73736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(CC)C1=CC=CC=C1C)NC(=O)NC2=C(N=C(C=C2SC)C)SC

Isomeric SMILES

CCCCCC(CC(CC)C1=CC=CC=C1C)NC(=O)NC2=C(N=C(C=C2SC)C)SC

InChI

InChI=1S/C26H39N3OS2/c1-7-9-10-14-21(17-20(8-2)22-15-12-11-13-18(22)3)28-26(30)29-24-23(31-5)16-19(4)27-25(24)32-6/h11-13,15-16,20-21H,7-10,14,17H2,1-6H3,(H2,28,29,30)