N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-3,6-diphenyl-thiane-2-carboxamide

Systemtic Name: N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-3,6-diphenyl-thiane-2-carboxamide Openeye Name: N-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]-3,6-diphenyl-tetrahydrothiopyran-2-carboxamide CAS Name: N-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]-3,6-diphenyl-2-thianecarboxamide IUPAC Name: N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-3,6-diphenylthiane-2-carboxamide Traditional Name: N-[6-methyl-2,4-bis(methylthio)-3-pyridyl]-3,6-diphenyl-tetrahydrothiopyran-2-carboxamide Formula: C26H28N2OS3 MolecularWeight: 480.70832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)SC)NC(=O)C2C(CCC(S2)C3=CC=CC=C3)C4=CC=CC=C4)SC

Isomeric SMILES

CC1=NC(=C(C(=C1)SC)NC(=O)C2C(CCC(S2)C3=CC=CC=C3)C4=CC=CC=C4)SC

InChI

InChI=1S/C26H28N2OS3/c1-17-16-22(30-2)23(26(27-17)31-3)28-25(29)24-20(18-10-6-4-7-11-18)14-15-21(32-24)19-12-8-5-9-13-19/h4-13,16,20-21,24H,14-15H2,1-3H3,(H,28,29)