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

Systemtic Name: 6-[[3-cyclohexyl-2-(7-ethylsulfonyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]amino]pyridine-3-carboxamide Openeye Name: 6-[[3-cyclohexyl-2-(7-ethylsulfonyl-4-oxo-quinazolin-3-yl)propanoyl]amino]pyridine-3-carboxamide CAS Name: 6-[[3-cyclohexyl-2-(7-ethylsulfonyl-4-oxo-3-quinazolinyl)-1-oxopropyl]amino]-3-pyridinecarboxamide IUPAC Name: 6-[[3-cyclohexyl-2-(7-ethylsulfonyl-4-oxoquinazolin-3-yl)propanoyl]amino]pyridine-3-carboxamide Traditional Name: 6-[[3-cyclohexyl-2-(7-esyl-4-keto-quinazolin-3-yl)propanoyl]amino]nicotinamide Formula: C25H29N5O5S MolecularWeight: 511.59326

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)C(=O)N(C=N2)C(CC3CCCCC3)C(=O)NC4=NC=C(C=C4)C(=O)N

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)C(=O)N(C=N2)C(CC3CCCCC3)C(=O)NC4=NC=C(C=C4)C(=O)N

InChI

InChI=1S/C25H29N5O5S/c1-2-36(34,35)18-9-10-19-20(13-18)28-15-30(25(19)33)21(12-16-6-4-3-5-7-16)24(32)29-22-11-8-17(14-27-22)23(26)31/h8-11,13-16,21H,2-7,12H2,1H3,(H2,26,31)(H,27,29,32)