2-[3-[4-methylsulfanyl-2-(piperidin-1-ylmethyl)thiophen-3-yl]propyl]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[3-[4-methylsulfanyl-2-(piperidin-1-ylmethyl)thiophen-3-yl]propyl]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[3-[4-methylsulfanyl-2-(1-piperidylmethyl)-3-thienyl]propyl]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[3-[4-(methylthio)-2-(1-piperidinylmethyl)-3-thiophenyl]propyl]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[3-[4-methylsulfanyl-2-(piperidin-1-ylmethyl)thiophen-3-yl]propyl]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[3-[4-(methylthio)-2-(piperidinomethyl)-3-thienyl]propyl]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one Formula: C24H30N4OS2 MolecularWeight: 454.6512

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CSC(=C1CCCC2=NC=C(C(=O)N2)CC3=CN=CC=C3)CN4CCCCC4

Isomeric SMILES

CSC1=CSC(=C1CCCC2=NC=C(C(=O)N2)CC3=CN=CC=C3)CN4CCCCC4

InChI

InChI=1S/C24H30N4OS2/c1-30-22-17-31-21(16-28-11-3-2-4-12-28)20(22)8-5-9-23-26-15-19(24(29)27-23)13-18-7-6-10-25-14-18/h6-7,10,14-15,17H,2-5,8-9,11-13,16H2,1H3,(H,26,27,29)