3-[4-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]carbonylphenyl]quinazolin-4-one

Systemtic Name: 3-[4-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]carbonylphenyl]quinazolin-4-one Openeye Name: 3-[4-[4-[(5-methyl-2-thienyl)sulfonyl]piperazine-1-carbonyl]phenyl]quinazolin-4-one CAS Name: 3-[4-[[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]-oxomethyl]phenyl]-4-quinazolinone IUPAC Name: 3-[4-[4-(5-methylthiophen-2-yl)sulfonylpiperazine-1-carbonyl]phenyl]quinazolin-4-one Traditional Name: 3-[4-[4-[(5-methyl-2-thienyl)sulfonyl]piperazine-1-carbonyl]phenyl]quinazolin-4-one Formula: C24H22N4O4S2 MolecularWeight: 494.58588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C24H22N4O4S2/c1-17-6-11-22(33-17)34(31,32)27-14-12-26(13-15-27)23(29)18-7-9-19(10-8-18)28-16-25-21-5-3-2-4-20(21)24(28)30/h2-11,16H,12-15H2,1H3