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

Systemtic Name: 1-[1-(2-ethylphenyl)butyl]-3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]urea Openeye Name: 1-[1-(2-ethylphenyl)butyl]-3-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]urea CAS Name: 1-[1-(2-ethylphenyl)butyl]-3-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]urea IUPAC Name: 1-[1-(2-ethylphenyl)butyl]-3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]urea Traditional Name: 1-[1-(2-ethylphenyl)butyl]-3-[6-methyl-2,4-bis(methylthio)-3-pyridyl]urea Formula: C21H29N3OS2 MolecularWeight: 403.60446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1CC)NC(=O)NC2=C(N=C(C=C2SC)C)SC

Isomeric SMILES

CCCC(C1=CC=CC=C1CC)NC(=O)NC2=C(N=C(C=C2SC)C)SC

InChI

InChI=1S/C21H29N3OS2/c1-6-10-17(16-12-9-8-11-15(16)7-2)23-21(25)24-19-18(26-4)13-14(3)22-20(19)27-5/h8-9,11-13,17H,6-7,10H2,1-5H3,(H2,23,24,25)