2-(7-chloranyl-3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)propanamide

Systemtic Name: 2-(7-chloranyl-3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)propanamide Openeye Name: 2-(7-chloro-3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-methyl-3-morpholinosulfonyl-phenyl)propanamide CAS Name: 2-[(7-chloro-3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(7-chloro-3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: 2-[(7-chloro-3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-(4-methyl-3-morpholinosulfonyl-phenyl)propionamide Formula: C27H31ClN4O5S2 MolecularWeight: 591.14184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4CCCC4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4CCCC4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C27H31ClN4O5S2/c1-17-7-9-20(16-24(17)39(35,36)31-11-13-37-14-12-31)29-25(33)18(2)38-27-30-23-15-19(28)8-10-22(23)26(34)32(27)21-5-3-4-6-21/h7-10,15-16,18,21H,3-6,11-14H2,1-2H3,(H,29,33)