2-methyl-3-[4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)carbonylphenyl]quinazolin-4-one

Systemtic Name: 2-methyl-3-[4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)carbonylphenyl]quinazolin-4-one Openeye Name: 2-methyl-3-[4-[4-(thiophene-2-carbonyl)piperazine-1-carbonyl]phenyl]quinazolin-4-one CAS Name: 2-methyl-3-[4-[oxo-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methyl]phenyl]-4-quinazolinone IUPAC Name: 2-methyl-3-[4-[4-(thiophene-2-carbonyl)piperazine-1-carbonyl]phenyl]quinazolin-4-one Traditional Name: 2-methyl-3-[4-[4-(2-thenoyl)piperazine-1-carbonyl]phenyl]quinazolin-4-one Formula: C25H22N4O3S MolecularWeight: 458.53218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)N4CCN(CC4)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)N4CCN(CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C25H22N4O3S/c1-17-26-21-6-3-2-5-20(21)24(31)29(17)19-10-8-18(9-11-19)23(30)27-12-14-28(15-13-27)25(32)22-7-4-16-33-22/h2-11,16H,12-15H2,1H3