N-[4,6-bis(methylsulfanyl)pyrimidin-5-yl]-6-heptyl-3,4-dimethyl-cyclohex-3-ene-1-carboxamide

Systemtic Name: N-[4,6-bis(methylsulfanyl)pyrimidin-5-yl]-6-heptyl-3,4-dimethyl-cyclohex-3-ene-1-carboxamide Openeye Name: N-[4,6-bis(methylsulfanyl)pyrimidin-5-yl]-6-heptyl-3,4-dimethyl-cyclohex-3-ene-1-carboxamide CAS Name: N-[4,6-bis(methylthio)-5-pyrimidinyl]-6-heptyl-3,4-dimethyl-1-cyclohex-3-enecarboxamide IUPAC Name: N-[4,6-bis(methylsulfanyl)pyrimidin-5-yl]-6-heptyl-3,4-dimethylcyclohex-3-ene-1-carboxamide Traditional Name: N-[4,6-bis(methylthio)pyrimidin-5-yl]-6-heptyl-3,4-dimethyl-cyclohex-3-ene-1-carboxamide Formula: C22H35N3OS2 MolecularWeight: 421.6628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CC(=C(CC1C(=O)NC2=C(N=CN=C2SC)SC)C)C

Isomeric SMILES

CCCCCCCC1CC(=C(CC1C(=O)NC2=C(N=CN=C2SC)SC)C)C

InChI

InChI=1S/C22H35N3OS2/c1-6-7-8-9-10-11-17-12-15(2)16(3)13-18(17)20(26)25-19-21(27-4)23-14-24-22(19)28-5/h14,17-18H,6-13H2,1-5H3,(H,25,26)