1-[2,6-bis(chloranyl)-4-(phenylsulfanylmethyl)pyridin-3-yl]hex-5-en-1-one

Systemtic Name: 1-[2,6-bis(chloranyl)-4-(phenylsulfanylmethyl)pyridin-3-yl]hex-5-en-1-one Openeye Name: 1-[2,6-dichloro-4-(phenylsulfanylmethyl)-3-pyridyl]hex-5-en-1-one CAS Name: 1-[2,6-dichloro-4-[(phenylthio)methyl]-3-pyridinyl]-5-hexen-1-one IUPAC Name: 1-[2,6-dichloro-4-(phenylsulfanylmethyl)pyridin-3-yl]hex-5-en-1-one Traditional Name: 1-[2,6-dichloro-4-[(phenylthio)methyl]-3-pyridyl]hex-5-en-1-one Formula: C18H17Cl2NOS MolecularWeight: 366.30468

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCC(=O)C1=C(N=C(C=C1CSC2=CC=CC=C2)Cl)Cl

Isomeric SMILES

C=CCCCC(=O)C1=C(N=C(C=C1CSC2=CC=CC=C2)Cl)Cl

InChI

InChI=1S/C18H17Cl2NOS/c1-2-3-5-10-15(22)17-13(11-16(19)21-18(17)20)12-23-14-8-6-4-7-9-14/h2,4,6-9,11H,1,3,5,10,12H2