N-[1-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]piperidin-4-yl]benzamide

Systemtic Name: N-[1-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]piperidin-4-yl]benzamide Openeye Name: N-[1-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]-4-piperidyl]benzamide CAS Name: N-[1-[3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-1-oxopropyl]-4-piperidinyl]benzamide IUPAC Name: N-[1-[3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propanoyl]-4-piperidyl]benzamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N2CCC(CC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N2CCC(CC2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28N4O2S/c1-15-19(16(2)24-22(23-15)29-3)9-10-20(27)26-13-11-18(12-14-26)25-21(28)17-7-5-4-6-8-17/h4-8,18H,9-14H2,1-3H3,(H,25,28)