8-methyl-3-[4-oxidanylidene-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)butyl]quinazolin-4-one

Systemtic Name: 8-methyl-3-[4-oxidanylidene-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)butyl]quinazolin-4-one Openeye Name: 8-methyl-3-[4-oxo-4-[4-(2-thienylsulfonyl)piperazin-1-yl]butyl]quinazolin-4-one CAS Name: 8-methyl-3-[4-oxo-4-(4-thiophen-2-ylsulfonyl-1-piperazinyl)butyl]-4-quinazolinone IUPAC Name: 8-methyl-3-[4-oxo-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)butyl]quinazolin-4-one Traditional Name: 3-[4-keto-4-[4-(2-thienylsulfonyl)piperazino]butyl]-8-methyl-quinazolin-4-one Formula: C21H24N4O4S2 MolecularWeight: 460.56966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H24N4O4S2/c1-16-5-2-6-17-20(16)22-15-24(21(17)27)9-3-7-18(26)23-10-12-25(13-11-23)31(28,29)19-8-4-14-30-19/h2,4-6,8,14-15H,3,7,9-13H2,1H3