N-butyl-N-ethyl-3-(2-methylpropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-butyl-N-ethyl-3-(2-methylpropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-butyl-N-ethyl-3-isobutyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-butyl-N-ethyl-3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-butyl-N-ethyl-3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-butyl-N-ethyl-3-isobutyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C19H27N3O2S MolecularWeight: 361.50158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O2S/c1-5-7-10-21(6-2)17(23)14-8-9-15-16(11-14)20-19(25)22(18(15)24)12-13(3)4/h8-9,11,13H,5-7,10,12H2,1-4H3,(H,20,25)