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2-(9-phenylnonylsulfanyl)-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one

2-(9-phenylnonylsulfanyl)-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name:2-(9-phenylnonylsulfanyl)-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one
Openeye Name:2-(9-phenylnonylsulfanyl)-5-(3-pyridylmethyl)-1H-pyrimidin-6-one
CAS Name:2-(9-phenylnonylthio)-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one
IUPAC Name:2-(9-phenylnonylsulfanyl)-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one
Traditional Name:2-(9-phenylnonylthio)-5-(3-pyridylmethyl)-1H-pyrimidin-6-one
Formula: C25H31N3OS
MolecularWeight: 421.59814
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCCCCSC2=NC=C(C(=O)N2)CC3=CN=CC=C3


Isomeric SMILES

C1=CC=C(C=C1)CCCCCCCCCSC2=NC=C(C(=O)N2)CC3=CN=CC=C3


InChI

InChI=1S/C25H31N3OS/c29-24-23(18-22-15-11-16-26-19-22)20-27-25(28-24)30-17-10-5-3-1-2-4-7-12-21-13-8-6-9-14-21/h6,8-9,11,13-16,19-20H,1-5,7,10,12,17-18H2,(H,27,28,29)


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