6-[[3-cyclohexyl-2-(7-cyclopentylsulfonyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]amino]pyridine-3-carboxamide

Systemtic Name: 6-[[3-cyclohexyl-2-(7-cyclopentylsulfonyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]amino]pyridine-3-carboxamide Openeye Name: 6-[[3-cyclohexyl-2-(7-cyclopentylsulfonyl-4-oxo-quinazolin-3-yl)propanoyl]amino]pyridine-3-carboxamide CAS Name: 6-[[3-cyclohexyl-2-(7-cyclopentylsulfonyl-4-oxo-3-quinazolinyl)-1-oxopropyl]amino]-3-pyridinecarboxamide IUPAC Name: 6-[[3-cyclohexyl-2-(7-cyclopentylsulfonyl-4-oxoquinazolin-3-yl)propanoyl]amino]pyridine-3-carboxamide Traditional Name: 6-[[3-cyclohexyl-2-(7-cyclopentylsulfonyl-4-keto-quinazolin-3-yl)propanoyl]amino]nicotinamide Formula: C28H33N5O5S MolecularWeight: 551.65712

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC2=NC=C(C=C2)C(=O)N)N3C=NC4=C(C3=O)C=CC(=C4)S(=O)(=O)C5CCCC5

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NC2=NC=C(C=C2)C(=O)N)N3C=NC4=C(C3=O)C=CC(=C4)S(=O)(=O)C5CCCC5

InChI

InChI=1S/C28H33N5O5S/c29-26(34)19-10-13-25(30-16-19)32-27(35)24(14-18-6-2-1-3-7-18)33-17-31-23-15-21(11-12-22(23)28(33)36)39(37,38)20-8-4-5-9-20/h10-13,15-18,20,24H,1-9,14H2,(H2,29,34)(H,30,32,35)