7-chloranyl-2-[[[2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-ethyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[[2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-ethyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[[2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-ethyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[[2-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-ethylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[[2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-ethylamino]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[ethyl-[2-keto-2-(4-p-phenetylsulfonylpiperazino)ethyl]amino]methyl]-1H-quinazolin-4-one Formula: C25H30ClN5O5S MolecularWeight: 548.0542

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OCC

Isomeric SMILES

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OCC

InChI

InChI=1S/C25H30ClN5O5S/c1-3-29(16-23-27-22-15-18(26)5-10-21(22)25(33)28-23)17-24(32)30-11-13-31(14-12-30)37(34,35)20-8-6-19(7-9-20)36-4-2/h5-10,15H,3-4,11-14,16-17H2,1-2H3,(H,27,28,33)