6-(4-methylpiperidin-1-yl)sulfonyl-3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]quinazolin-4-one

Systemtic Name: 6-(4-methylpiperidin-1-yl)sulfonyl-3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]quinazolin-4-one Openeye Name: 6-[(4-methyl-1-piperidyl)sulfonyl]-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]quinazolin-4-one CAS Name: 6-[(4-methyl-1-piperidinyl)sulfonyl]-3-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-4-quinazolinone IUPAC Name: 6-(4-methylpiperidin-1-yl)sulfonyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]quinazolin-4-one Traditional Name: 3-[2-keto-2-(4-phenylpiperazino)ethyl]-6-(4-methylpiperidino)sulfonyl-quinazolin-4-one Formula: C26H31N5O4S MolecularWeight: 509.62044

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=CN(C3=O)CC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=CN(C3=O)CC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C26H31N5O4S/c1-20-9-11-31(12-10-20)36(34,35)22-7-8-24-23(17-22)26(33)30(19-27-24)18-25(32)29-15-13-28(14-16-29)21-5-3-2-4-6-21/h2-8,17,19-20H,9-16,18H2,1H3