3-[2-oxidanylidene-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]quinazolin-4-one

Systemtic Name: 3-[2-oxidanylidene-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]quinazolin-4-one Openeye Name: 3-[2-oxo-2-[4-(2-thienylsulfonyl)piperazin-1-yl]ethyl]quinazolin-4-one CAS Name: 3-[2-oxo-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethyl]-4-quinazolinone IUPAC Name: 3-[2-oxo-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]quinazolin-4-one Traditional Name: 3-[2-keto-2-[4-(2-thienylsulfonyl)piperazino]ethyl]quinazolin-4-one Formula: C18H18N4O4S2 MolecularWeight: 418.48992

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=NC3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=NC3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H18N4O4S2/c23-16(12-21-13-19-15-5-2-1-4-14(15)18(21)24)20-7-9-22(10-8-20)28(25,26)17-6-3-11-27-17/h1-6,11,13H,7-10,12H2