2-[7-chloranyl-4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-(1-ethylpiperidin-4-yl)ethanamide

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-(1-ethylpiperidin-4-yl)ethanamide Openeye Name: 2-[7-chloro-3-(2-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(1-ethyl-4-piperidyl)acetamide CAS Name: 2-[[7-chloro-4-oxo-3-(2-propan-2-ylphenyl)-2-quinazolinyl]thio]-N-(1-ethyl-4-piperidinyl)acetamide IUPAC Name: 2-[7-chloro-4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-(1-ethylpiperidin-4-yl)acetamide Traditional Name: 2-[(7-chloro-4-keto-3-o-cumenyl-quinazolin-2-yl)thio]-N-(1-ethyl-4-piperidyl)acetamide Formula: C26H31ClN4O2S MolecularWeight: 499.06794

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)NC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=CC=C4C(C)C

Isomeric SMILES

CCN1CCC(CC1)NC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=CC=C4C(C)C

InChI

InChI=1S/C26H31ClN4O2S/c1-4-30-13-11-19(12-14-30)28-24(32)16-34-26-29-22-15-18(27)9-10-21(22)25(33)31(26)23-8-6-5-7-20(23)17(2)3/h5-10,15,17,19H,4,11-14,16H2,1-3H3,(H,28,32)