2-[7-chloranyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(cyclohexylcarbamoyl)propanamide

Systemtic Name: 2-[7-chloranyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(cyclohexylcarbamoyl)propanamide Openeye Name: 2-[7-chloro-3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(cyclohexylcarbamoyl)propanamide CAS Name: 2-[[7-chloro-3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-[(cyclohexylamino)-oxomethyl]propanamide IUPAC Name: 2-[7-chloro-3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(cyclohexylcarbamoyl)propanamide Traditional Name: 2-[[7-chloro-3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-(cyclohexylcarbamoyl)propionamide Formula: C23H31ClN4O4S MolecularWeight: 495.03464

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC(=O)NC3CCCCC3

Isomeric SMILES

CCOCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC(=O)NC3CCCCC3

InChI

InChI=1S/C23H31ClN4O4S/c1-3-32-13-7-12-28-21(30)18-11-10-16(24)14-19(18)26-23(28)33-15(2)20(29)27-22(31)25-17-8-5-4-6-9-17/h10-11,14-15,17H,3-9,12-13H2,1-2H3,(H2,25,27,29,31)