2-[[methyl-[1-oxidanylidene-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-2-yl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[methyl-[1-oxidanylidene-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-2-yl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[[2-[4-(benzenesulfonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]-methyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[[1-[4-(benzenesulfonyl)-1-piperazinyl]-1-oxopropan-2-yl]-methylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[[1-[4-(benzenesulfonyl)piperazin-1-yl]-1-oxopropan-2-yl]-methylamino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[[2-(4-besylpiperazino)-2-keto-1-methyl-ethyl]-methyl-amino]methyl]-1H-quinazolin-4-one Formula: C23H27N5O4S MolecularWeight: 469.55658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)N(C)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)N(C)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H27N5O4S/c1-17(26(2)16-21-24-20-11-7-6-10-19(20)22(29)25-21)23(30)27-12-14-28(15-13-27)33(31,32)18-8-4-3-5-9-18/h3-11,17H,12-16H2,1-2H3,(H,24,25,29)