4-oxidanylidene-N-(3-pyridin-3-ylpropyl)-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-(3-pyridin-3-ylpropyl)-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxamide Openeye Name: 4-oxo-N-[3-(3-pyridyl)propyl]-2-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxamide CAS Name: 4-oxo-N-[3-(3-pyridinyl)propyl]-2-sulfanylidene-1,5-dihydro[1]benzopyrano[2,3-d]pyrimidine-7-carboxamide IUPAC Name: 4-oxo-N-(3-pyridin-3-ylpropyl)-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxamide Traditional Name: 4-keto-N-[3-(3-pyridyl)propyl]-2-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxamide Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C(=O)NCCCC3=CN=CC=C3)OC4=C1C(=O)NC(=S)N4

Isomeric SMILES

C1C2=C(C=CC(=C2)C(=O)NCCCC3=CN=CC=C3)OC4=C1C(=O)NC(=S)N4

InChI

InChI=1S/C20H18N4O3S/c25-17(22-8-2-4-12-3-1-7-21-11-12)13-5-6-16-14(9-13)10-15-18(26)23-20(28)24-19(15)27-16/h1,3,5-7,9,11H,2,4,8,10H2,(H,22,25)(H2,23,24,26,28)