3-[2-oxidanylidene-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 3-[2-oxidanylidene-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-one Openeye Name: 3-[2-(4-benzylsulfonylpiperazin-1-yl)-2-oxo-ethyl]quinazolin-4-one CAS Name: 3-[2-oxo-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 3-[2-(4-benzylsulfonylpiperazin-1-yl)-2-oxoethyl]quinazolin-4-one Traditional Name: 3-[2-(4-benzylsulfonylpiperazino)-2-keto-ethyl]quinazolin-4-one Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=NC3=CC=CC=C3C2=O)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=NC3=CC=CC=C3C2=O)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O4S/c26-20(14-24-16-22-19-9-5-4-8-18(19)21(24)27)23-10-12-25(13-11-23)30(28,29)15-17-6-2-1-3-7-17/h1-9,16H,10-15H2