2-[[methyl-[2-oxidanylidene-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[methyl-[2-oxidanylidene-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[[2-(4-benzylsulfonylpiperazin-1-yl)-2-oxo-ethyl]-methyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[methyl-[2-oxo-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[[2-(4-benzylsulfonylpiperazin-1-yl)-2-oxoethyl]-methylamino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[[2-(4-benzylsulfonylpiperazino)-2-keto-ethyl]-methyl-amino]methyl]-1H-quinazolin-4-one Formula: C23H27N5O4S MolecularWeight: 469.55658

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O4S/c1-26(15-21-24-20-10-6-5-9-19(20)23(30)25-21)16-22(29)27-11-13-28(14-12-27)33(31,32)17-18-7-3-2-4-8-18/h2-10H,11-17H2,1H3,(H,24,25,30)