N3-cyclopentyl-5-oxidanylidene-N8-phenethyl-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide

Systemtic Name: N3-cyclopentyl-5-oxidanylidene-N8-phenethyl-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide Openeye Name: N3-cyclopentyl-5-oxo-N8-phenethyl-1-thioxo-4H-thiazolo[3,4-a]quinazoline-3,8-dicarboxamide CAS Name: N3-cyclopentyl-5-oxo-N8-phenethyl-1-sulfanylidene-4H-thiazolo[3,4-a]quinazoline-3,8-dicarboxamide IUPAC Name: 3-N-cyclopentyl-5-oxo-8-N-phenethyl-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide Traditional Name: N-cyclopentyl-5-keto-N'-phenethyl-1-thioxo-4H-thiazolo[3,4-a]quinazoline-3,8-dicarboxamide Formula: C25H24N4O3S2 MolecularWeight: 492.61306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=C3NC(=O)C4=C(N3C(=S)S2)C=C(C=C4)C(=O)NCCC5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)NC(=O)C2=C3NC(=O)C4=C(N3C(=S)S2)C=C(C=C4)C(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C25H24N4O3S2/c30-22(26-13-12-15-6-2-1-3-7-15)16-10-11-18-19(14-16)29-21(28-23(18)31)20(34-25(29)33)24(32)27-17-8-4-5-9-17/h1-3,6-7,10-11,14,17H,4-5,8-9,12-13H2,(H,26,30)(H,27,32)(H,28,31)