2-[3-(4-ethanoylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[3-(4-ethanoylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[3-(4-acetylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[[3-(4-acetylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[3-(4-acetylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[[3-(4-acetylphenyl)-4-keto-quinazolin-2-yl]thio]-N-(3-piperidinosulfonylphenyl)acetamide Formula: C29H28N4O5S2 MolecularWeight: 576.68642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C29H28N4O5S2/c1-20(34)21-12-14-23(15-13-21)33-28(36)25-10-3-4-11-26(25)31-29(33)39-19-27(35)30-22-8-7-9-24(18-22)40(37,38)32-16-5-2-6-17-32/h3-4,7-15,18H,2,5-6,16-17,19H2,1H3,(H,30,35)