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

Systemtic Name: 2-[3-oxidanylidene-3-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propyl]-1H-quinazolin-4-one Openeye Name: 2-[3-oxo-3-[4-(2-thienylsulfonyl)piperazin-1-yl]propyl]-1H-quinazolin-4-one CAS Name: 2-[3-oxo-3-(4-thiophen-2-ylsulfonyl-1-piperazinyl)propyl]-1H-quinazolin-4-one IUPAC Name: 2-[3-oxo-3-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propyl]-1H-quinazolin-4-one Traditional Name: 2-[3-keto-3-[4-(2-thienylsulfonyl)piperazino]propyl]-1H-quinazolin-4-one Formula: C19H20N4O4S2 MolecularWeight: 432.5165

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=NC(=O)C3=CC=CC=C3N2)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=NC(=O)C3=CC=CC=C3N2)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H20N4O4S2/c24-17(8-7-16-20-15-5-2-1-4-14(15)19(25)21-16)22-9-11-23(12-10-22)29(26,27)18-6-3-13-28-18/h1-6,13H,7-12H2,(H,20,21,25)