2-[3-(4-butan-2-ylphenyl)-7-chloranyl-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methoxyethyl)ethanamide

Systemtic Name: 2-[3-(4-butan-2-ylphenyl)-7-chloranyl-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methoxyethyl)ethanamide Openeye Name: 2-[7-chloro-4-oxo-3-(4-sec-butylphenyl)quinazolin-2-yl]sulfanyl-N-(2-methoxyethyl)acetamide CAS Name: 2-[[3-(4-butan-2-ylphenyl)-7-chloro-4-oxo-2-quinazolinyl]thio]-N-(2-methoxyethyl)acetamide IUPAC Name: 2-[3-(4-butan-2-ylphenyl)-7-chloro-4-oxoquinazolin-2-yl]sulfanyl-N-(2-methoxyethyl)acetamide Traditional Name: 2-[[7-chloro-4-keto-3-(4-sec-butylphenyl)quinazolin-2-yl]thio]-N-(2-methoxyethyl)acetamide Formula: C23H26ClN3O3S MolecularWeight: 459.98884

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NCCOC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NCCOC

InChI

InChI=1S/C23H26ClN3O3S/c1-4-15(2)16-5-8-18(9-6-16)27-22(29)19-10-7-17(24)13-20(19)26-23(27)31-14-21(28)25-11-12-30-3/h5-10,13,15H,4,11-12,14H2,1-3H3,(H,25,28)