2-(6-methyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(6-methyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(6-methyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-[4-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(6-methyl-2-phenyl-4-quinazolinyl)thio]-N-[4-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(6-methyl-2-phenylquinazolin-4-yl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(6-methyl-2-phenyl-quinazolin-4-yl)thio]-N-(4-piperidinosulfonylphenyl)acetamide Formula: C28H28N4O3S2 MolecularWeight: 532.67692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O3S2/c1-20-10-15-25-24(18-20)28(31-27(30-25)21-8-4-2-5-9-21)36-19-26(33)29-22-11-13-23(14-12-22)37(34,35)32-16-6-3-7-17-32/h2,4-5,8-15,18H,3,6-7,16-17,19H2,1H3,(H,29,33)