3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide

Systemtic Name: 3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide Openeye Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C21H22N4O5S2 MolecularWeight: 474.55318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C21H22N4O5S2/c26-18-8-7-14(32(29,30)24-10-3-4-11-24)13-17(18)22-19(27)9-12-25-20(28)15-5-1-2-6-16(15)23-21(25)31/h1-2,5-8,13,26H,3-4,9-12H2,(H,22,27)(H,23,31)