2-[(1-methylsulfonylpiperidin-4-yl)amino]-6-(phenylcarbonyl)-1H-quinazolin-7-one

Systemtic Name: 2-[(1-methylsulfonylpiperidin-4-yl)amino]-6-(phenylcarbonyl)-1H-quinazolin-7-one Openeye Name: 6-benzoyl-2-[(1-methylsulfonyl-4-piperidyl)amino]-1H-quinazolin-7-one CAS Name: 6-benzoyl-2-[(1-methylsulfonyl-4-piperidinyl)amino]-1H-quinazolin-7-one IUPAC Name: 6-benzoyl-2-[(1-methylsulfonylpiperidin-4-yl)amino]-1H-quinazolin-7-one Traditional Name: 6-benzoyl-2-[(1-mesyl-4-piperidyl)amino]-1H-quinazolin-7-one Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC2=NC=C3C=C(C(=O)C=C3N2)C(=O)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC2=NC=C3C=C(C(=O)C=C3N2)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O4S/c1-30(28,29)25-9-7-16(8-10-25)23-21-22-13-15-11-17(19(26)12-18(15)24-21)20(27)14-5-3-2-4-6-14/h2-6,11-13,16H,7-10H2,1H3,(H2,22,23,24)