5-oxidanylidene-N8-(4-phenylbutan-2-yl)-N3-propan-2-yl-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide

Systemtic Name: 5-oxidanylidene-N8-(4-phenylbutan-2-yl)-N3-propan-2-yl-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide Openeye Name: N3-isopropyl-N8-(1-methyl-3-phenyl-propyl)-5-oxo-1-thioxo-4H-thiazolo[3,4-a]quinazoline-3,8-dicarboxamide CAS Name: 5-oxo-N8-(4-phenylbutan-2-yl)-N3-propan-2-yl-1-sulfanylidene-4H-thiazolo[3,4-a]quinazoline-3,8-dicarboxamide IUPAC Name: 5-oxo-8-N-(4-phenylbutan-2-yl)-3-N-propan-2-yl-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide Traditional Name: N-isopropyl-5-keto-N'-(1-methyl-3-phenyl-propyl)-1-thioxo-4H-thiazolo[3,4-a]quinazoline-3,8-dicarboxamide Formula: C25H26N4O3S2 MolecularWeight: 494.62894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=C2NC(=O)C3=C(N2C(=S)S1)C=C(C=C3)C(=O)NC(C)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)NC(=O)C1=C2NC(=O)C3=C(N2C(=S)S1)C=C(C=C3)C(=O)NC(C)CCC4=CC=CC=C4

InChI

InChI=1S/C25H26N4O3S2/c1-14(2)26-24(32)20-21-28-23(31)18-12-11-17(13-19(18)29(21)25(33)34-20)22(30)27-15(3)9-10-16-7-5-4-6-8-16/h4-8,11-15H,9-10H2,1-3H3,(H,26,32)(H,27,30)(H,28,31)