2-[7-chloranyl-3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(4-methylphenyl)carbamoyl]propanamide

Systemtic Name: 2-[7-chloranyl-3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(4-methylphenyl)carbamoyl]propanamide Openeye Name: 2-[7-chloro-3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(p-tolylcarbamoyl)propanamide CAS Name: 2-[[7-chloro-3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-[(4-methylanilino)-oxomethyl]propanamide IUPAC Name: 2-[7-chloro-3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(4-methylphenyl)carbamoyl]propanamide Traditional Name: 2-[[7-chloro-4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]-N-(p-tolylcarbamoyl)propionamide Formula: C23H25ClN4O4S MolecularWeight: 488.987

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC(=O)C(C)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCCOC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC(=O)C(C)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCCOC

InChI

InChI=1S/C23H25ClN4O4S/c1-14-5-8-17(9-6-14)25-22(31)27-20(29)15(2)33-23-26-19-13-16(24)7-10-18(19)21(30)28(23)11-4-12-32-3/h5-10,13,15H,4,11-12H2,1-3H3,(H2,25,27,29,31)