1-ethyl-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-ethyl-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-ethyl-6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-2-thioxo-pyrimidin-4-one CAS Name: 1-ethyl-6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-ethyl-6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-2-sulfanylidenepyrimidin-4-one Traditional Name: 1-ethyl-6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxol[4,5-g]isoquinolin-5-yl)-2-thioxo-pyrimidin-4-one Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=O)NC1=S)C2C3=C(C4=C(C=C3CCN2C)OCO4)OC)O

Isomeric SMILES

CCN1C(=C(C(=O)NC1=S)C2C3=C(C4=C(C=C3CCN2C)OCO4)OC)O

InChI

InChI=1S/C18H21N3O5S/c1-4-21-17(23)12(16(22)19-18(21)27)13-11-9(5-6-20(13)2)7-10-14(15(11)24-3)26-8-25-10/h7,13,23H,4-6,8H2,1-3H3,(H,19,22,27)