N-octyl-4-oxidanylidene-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxamide

Systemtic Name: N-octyl-4-oxidanylidene-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxamide Openeye Name: N-octyl-4-oxo-2-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxamide CAS Name: N-octyl-4-oxo-2-sulfanylidene-1,5-dihydro[1]benzopyrano[2,3-d]pyrimidine-7-carboxamide IUPAC Name: N-octyl-4-oxo-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxamide Traditional Name: 4-keto-N-octyl-2-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxamide Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C1=CC2=C(C=C1)OC3=C(C2)C(=O)NC(=S)N3

Isomeric SMILES

CCCCCCCCNC(=O)C1=CC2=C(C=C1)OC3=C(C2)C(=O)NC(=S)N3

InChI

InChI=1S/C20H25N3O3S/c1-2-3-4-5-6-7-10-21-17(24)13-8-9-16-14(11-13)12-15-18(25)22-20(27)23-19(15)26-16/h8-9,11H,2-7,10,12H2,1H3,(H,21,24)(H2,22,23,25,27)