N-[3-(diethylaminomethyl)phenyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide

Systemtic Name: N-[3-(diethylaminomethyl)phenyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Openeye Name: N-[3-(diethylaminomethyl)phenyl]-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-[3-(diethylaminomethyl)phenyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide IUPAC Name: N-[3-(diethylaminomethyl)phenyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Traditional Name: N-[3-(diethylaminomethyl)phenyl]-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanamide Formula: C25H32N4O2S MolecularWeight: 452.61218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC(=CC=C1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CCN(CC)CC1=CC(=CC=C1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C25H32N4O2S/c1-3-28(4-2)18-19-11-10-12-20(17-19)26-23(30)15-6-5-9-16-29-24(31)21-13-7-8-14-22(21)27-25(29)32/h7-8,10-14,17H,3-6,9,15-16,18H2,1-2H3,(H,26,30)(H,27,32)