8-methyl-3-[2-oxidanylidene-2-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 8-methyl-3-[2-oxidanylidene-2-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]ethyl]quinazolin-4-one Openeye Name: 8-methyl-3-[2-oxo-2-[4-[(5-phenyl-2-thienyl)methyl]piperazin-1-yl]ethyl]quinazolin-4-one CAS Name: 8-methyl-3-[2-oxo-2-[4-[(5-phenyl-2-thiophenyl)methyl]-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 8-methyl-3-[2-oxo-2-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]ethyl]quinazolin-4-one Traditional Name: 3-[2-keto-2-[4-[(5-phenyl-2-thienyl)methyl]piperazino]ethyl]-8-methyl-quinazolin-4-one Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)N3CCN(CC3)CC4=CC=C(S4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)N3CCN(CC3)CC4=CC=C(S4)C5=CC=CC=C5

InChI

InChI=1S/C26H26N4O2S/c1-19-6-5-9-22-25(19)27-18-30(26(22)32)17-24(31)29-14-12-28(13-15-29)16-21-10-11-23(33-21)20-7-3-2-4-8-20/h2-11,18H,12-17H2,1H3