ethyl 2-[3-hexyl-2,4-bis(oxidanylidene)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-hexyl-2,4-bis(oxidanylidene)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-1-yl]ethanoate Openeye Name: ethyl 2-(3-hexyl-2,4-dioxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-1-yl)acetate CAS Name: 2-(3-hexyl-2,4-dioxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-1-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(3-hexyl-2,4-dioxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-1-yl)acetate Traditional Name: 2-(3-hexyl-2,4-diketo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-1-yl)acetic acid ethyl ester Formula: C20H28N2O4S MolecularWeight: 392.51232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=C(N(C1=O)CC(=O)OCC)SC3=C2CCCC3

Isomeric SMILES

CCCCCCN1C(=O)C2=C(N(C1=O)CC(=O)OCC)SC3=C2CCCC3

InChI

InChI=1S/C20H28N2O4S/c1-3-5-6-9-12-21-18(24)17-14-10-7-8-11-15(14)27-19(17)22(20(21)25)13-16(23)26-4-2/h3-13H2,1-2H3