2-[4-(4-methylphenoxy)butylsulfanyl]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one

Systemtic Name: 2-[4-(4-methylphenoxy)butylsulfanyl]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one Openeye Name: 2-[4-(4-methylphenoxy)butylsulfanyl]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one CAS Name: 2-[4-(4-methylphenoxy)butylthio]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one IUPAC Name: 2-[4-(4-methylphenoxy)butylsulfanyl]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one Traditional Name: 2-[4-(4-methylphenoxy)butylthio]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCCSC2=NC(=O)C3=C(N2)CCC3

Isomeric SMILES

CC1=CC=C(C=C1)OCCCCSC2=NC(=O)C3=C(N2)CCC3

InChI

InChI=1S/C18H22N2O2S/c1-13-7-9-14(10-8-13)22-11-2-3-12-23-18-19-16-6-4-5-15(16)17(21)20-18/h7-10H,2-6,11-12H2,1H3,(H,19,20,21)