N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-4-oxidanylidene-4-phenyl-butanethioamide

Systemtic Name: N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-4-oxidanylidene-4-phenyl-butanethioamide Openeye Name: N-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]-4-oxo-4-phenyl-butanethioamide CAS Name: N-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]-4-oxo-4-phenylbutanethioamide IUPAC Name: N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-4-oxo-4-phenylbutanethioamide Traditional Name: 4-keto-N-[6-methyl-2,4-bis(methylthio)-3-pyridyl]-4-phenyl-thiobutyramide Formula: C18H20N2OS3 MolecularWeight: 376.5592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)SC)NC(=S)CCC(=O)C2=CC=CC=C2)SC

Isomeric SMILES

CC1=NC(=C(C(=C1)SC)NC(=S)CCC(=O)C2=CC=CC=C2)SC

InChI

InChI=1S/C18H20N2OS3/c1-12-11-15(23-2)17(18(19-12)24-3)20-16(22)10-9-14(21)13-7-5-4-6-8-13/h4-8,11H,9-10H2,1-3H3,(H,20,22)