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

Systemtic Name: 1-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-3-[2-(2-methylphenyl)octan-4-yl]urea Openeye Name: 1-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]-3-[1-[2-(o-tolyl)propyl]pentyl]urea CAS Name: 1-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]-3-[2-(2-methylphenyl)octan-4-yl]urea IUPAC Name: 1-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-3-[2-(2-methylphenyl)octan-4-yl]urea Traditional Name: 1-[6-methyl-2,4-bis(methylthio)-3-pyridyl]-3-[1-[2-(o-tolyl)propyl]pentyl]urea Formula: C24H35N3OS2 MolecularWeight: 445.6842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H35N3OS2/c1-7-8-12-19(14-17(3)20-13-10-9-11-16(20)2)26-24(28)27-22-21(29-5)15-18(4)25-23(22)30-6/h9-11,13,15,17,19H,7-8,12,14H2,1-6H3,(H2,26,27,28)