3-ethyl-N-hexyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-ethyl-N-hexyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-ethyl-N-hexyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-ethyl-N-hexyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-ethyl-N-hexyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-ethyl-N-hexyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C17H23N3O2S MolecularWeight: 333.44842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC

Isomeric SMILES

CCCCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC

InChI

InChI=1S/C17H23N3O2S/c1-3-5-6-7-10-18-15(21)12-8-9-13-14(11-12)19-17(23)20(4-2)16(13)22/h8-9,11H,3-7,10H2,1-2H3,(H,18,21)(H,19,23)