2-(7-chloranyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(7-chloro-4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[(7-chloro-4-oxo-3-phenyl-2-quinazolinyl)thio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-phenylquinazolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(7-chloro-4-keto-3-phenyl-quinazolin-2-yl)thio]-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C26H23ClN4O4S2 MolecularWeight: 555.06822

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C26H23ClN4O4S2/c27-18-8-13-22-23(16-18)29-26(31(25(22)33)20-6-2-1-3-7-20)36-17-24(32)28-19-9-11-21(12-10-19)37(34,35)30-14-4-5-15-30/h1-3,6-13,16H,4-5,14-15,17H2,(H,28,32)