6-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]carbonyl-5-methyl-2-(methylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]carbonyl-5-methyl-2-(methylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]-5-methyl-2-(methylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-[[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperidinyl]-oxomethyl]-5-methyl-2-[(methylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]-5-methyl-2-(methylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]-5-methyl-2-[(methylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC)C(=O)N3CCC(CC3)C(=O)C4=CC=C(C=C4)O

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC)C(=O)N3CCC(CC3)C(=O)C4=CC=C(C=C4)O

InChI

InChI=1S/C22H23N3O4S2/c1-12-17-20(28)23-16(11-30-2)24-21(17)31-19(12)22(29)25-9-7-14(8-10-25)18(27)13-3-5-15(26)6-4-13/h3-6,14,26H,7-11H2,1-2H3,(H,23,24,28)