(6E)-5-azanylidene-2-(thiophen-2-ylmethyl)-6-[(3,4,5-trimethoxyphenyl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: (6E)-5-azanylidene-2-(thiophen-2-ylmethyl)-6-[(3,4,5-trimethoxyphenyl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: (6E)-5-imino-2-(2-thienylmethyl)-6-[(3,4,5-trimethoxyphenyl)methylene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: (6E)-5-imino-2-(thiophen-2-ylmethyl)-6-[(3,4,5-trimethoxyphenyl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: (6E)-5-imino-2-(thiophen-2-ylmethyl)-6-[(3,4,5-trimethoxyphenyl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: (6E)-5-imino-2-(2-thenyl)-6-(3,4,5-trimethoxybenzylidene)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C20H18N4O4S2 MolecularWeight: 442.51132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=C2C(=N)N3C(=NC2=O)SC(=N3)CC4=CC=CS4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/2\C(=N)N3C(=NC2=O)SC(=N3)CC4=CC=CS4

InChI

InChI=1S/C20H18N4O4S2/c1-26-14-8-11(9-15(27-2)17(14)28-3)7-13-18(21)24-20(22-19(13)25)30-16(23-24)10-12-5-4-6-29-12/h4-9,21H,10H2,1-3H3/b13-7+,21-18?