N-(2-ethylhexyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(2-ethylhexyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(2-ethylhexyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(2-ethylhexyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(2-ethylhexyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(2-ethylhexyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=CC2=C(C=C1)C(=O)NC(=S)N2

Isomeric SMILES

CCCCC(CC)CNC(=O)C1=CC2=C(C=C1)C(=O)NC(=S)N2

InChI

InChI=1S/C17H23N3O2S/c1-3-5-6-11(4-2)10-18-15(21)12-7-8-13-14(9-12)19-17(23)20-16(13)22/h7-9,11H,3-6,10H2,1-2H3,(H,18,21)(H2,19,20,22,23)