N-[2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide

Systemtic Name: N-[2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Openeye Name: N-[2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-[2-(2-chlorophenyl)-2-(1-pyrrolidinyl)ethyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide IUPAC Name: N-[2-(2-chlorophenyl)-2-pyrrolidin-1-ylethyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Traditional Name: N-[2-(2-chlorophenyl)-2-pyrrolidino-ethyl]-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanamide Formula: C26H31ClN4O2S MolecularWeight: 499.06794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCN(C1)C(CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H31ClN4O2S/c27-21-12-5-3-10-19(21)23(30-15-8-9-16-30)18-28-24(32)14-2-1-7-17-31-25(33)20-11-4-6-13-22(20)29-26(31)34/h3-6,10-13,23H,1-2,7-9,14-18H2,(H,28,32)(H,29,34)