1-butoxy-3-[3-[(4-chloranyl-6-methyl-pyridin-2-yl)methylsulfanyl]phenyl]-1-methyl-thiourea

Systemtic Name: 1-butoxy-3-[3-[(4-chloranyl-6-methyl-pyridin-2-yl)methylsulfanyl]phenyl]-1-methyl-thiourea Openeye Name: 1-butoxy-3-[3-[(4-chloro-6-methyl-2-pyridyl)methylsulfanyl]phenyl]-1-methyl-thiourea CAS Name: 1-butoxy-3-[3-[(4-chloro-6-methyl-2-pyridinyl)methylthio]phenyl]-1-methylthiourea IUPAC Name: 1-butoxy-3-[3-[(4-chloro-6-methylpyridin-2-yl)methylsulfanyl]phenyl]-1-methylthiourea Traditional Name: 1-butoxy-3-[3-[(4-chloro-6-methyl-2-pyridyl)methylthio]phenyl]-1-methyl-thiourea Formula: C19H24ClN3OS2 MolecularWeight: 409.99636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCON(C)C(=S)NC1=CC(=CC=C1)SCC2=CC(=CC(=N2)C)Cl

Isomeric SMILES

CCCCON(C)C(=S)NC1=CC(=CC=C1)SCC2=CC(=CC(=N2)C)Cl

InChI

InChI=1S/C19H24ClN3OS2/c1-4-5-9-24-23(3)19(25)22-16-7-6-8-18(12-16)26-13-17-11-15(20)10-14(2)21-17/h6-8,10-12H,4-5,9,13H2,1-3H3,(H,22,25)