N-butyl-4-oxidanylidene-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-8-carboxamide

Systemtic Name: N-butyl-4-oxidanylidene-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-8-carboxamide Openeye Name: N-butyl-4-oxo-2-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidine-8-carboxamide CAS Name: N-butyl-4-oxo-2-sulfanylidene-1,5-dihydro[1]benzopyrano[2,3-d]pyrimidine-8-carboxamide IUPAC Name: N-butyl-4-oxo-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-8-carboxamide Traditional Name: N-butyl-4-keto-2-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidine-8-carboxamide Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC2=C(CC3=C(O2)NC(=S)NC3=O)C=C1

Isomeric SMILES

CCCCNC(=O)C1=CC2=C(CC3=C(O2)NC(=S)NC3=O)C=C1

InChI

InChI=1S/C16H17N3O3S/c1-2-3-6-17-13(20)10-5-4-9-7-11-14(21)18-16(23)19-15(11)22-12(9)8-10/h4-5,8H,2-3,6-7H2,1H3,(H,17,20)(H2,18,19,21,23)