2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-dimethylaminophenyl)propanamide

Systemtic Name: 2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-dimethylaminophenyl)propanamide Openeye Name: 2-(6-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-dimethylaminophenyl)propanamide CAS Name: 2-[[6-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-(4-dimethylaminophenyl)propanamide IUPAC Name: 2-[6-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-dimethylaminophenyl)propanamide Traditional Name: 2-[(6-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-(4-dimethylaminophenyl)propionamide Formula: C23H27ClN4O2S MolecularWeight: 459.00408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SC(C)C(=O)NC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SC(C)C(=O)NC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C23H27ClN4O2S/c1-14(2)13-28-22(30)19-12-16(24)6-11-20(19)26-23(28)31-15(3)21(29)25-17-7-9-18(10-8-17)27(4)5/h6-12,14-15H,13H2,1-5H3,(H,25,29)