3-cyclopentyl-2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 3-cyclopentyl-2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-cyclopentyl-2-[(7-methoxy-2-oxo-chromen-4-yl)methylsulfanyl]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 3-cyclopentyl-2-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methylthio]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 3-cyclopentyl-2-[(7-methoxy-2-oxochromen-4-yl)methylsulfanyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-cyclopentyl-2-[(2-keto-7-methoxy-chromen-4-yl)methylthio]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C26H26N2O4S2 MolecularWeight: 494.62564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(C5=C(S4)CCCC5)C(=O)N3C6CCCC6

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(C5=C(S4)CCCC5)C(=O)N3C6CCCC6

InChI

InChI=1S/C26H26N2O4S2/c1-31-17-10-11-18-15(12-22(29)32-20(18)13-17)14-33-26-27-24-23(19-8-4-5-9-21(19)34-24)25(30)28(26)16-6-2-3-7-16/h10-13,16H,2-9,14H2,1H3