2-(3-butyl-6-morpholin-4-yl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-propan-2-ylphenyl)ethanamide

Systemtic Name: 2-(3-butyl-6-morpholin-4-yl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-propan-2-ylphenyl)ethanamide Openeye Name: 2-(3-butyl-6-morpholino-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-isopropylphenyl)acetamide CAS Name: 2-[[3-butyl-6-(4-morpholinyl)-4-oxo-2-quinazolinyl]thio]-N-(4-propan-2-ylphenyl)acetamide IUPAC Name: 2-(3-butyl-6-morpholin-4-yl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-propan-2-ylphenyl)acetamide Traditional Name: 2-[(3-butyl-4-keto-6-morpholino-quinazolin-2-yl)thio]-N-p-cumenyl-acetamide Formula: C27H34N4O3S MolecularWeight: 494.64886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C=CC(=C2)N3CCOCC3)N=C1SCC(=O)NC4=CC=C(C=C4)C(C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(C=CC(=C2)N3CCOCC3)N=C1SCC(=O)NC4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C27H34N4O3S/c1-4-5-12-31-26(33)23-17-22(30-13-15-34-16-14-30)10-11-24(23)29-27(31)35-18-25(32)28-21-8-6-20(7-9-21)19(2)3/h6-11,17,19H,4-5,12-16,18H2,1-3H3,(H,28,32)