2-[[ethyl-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[[ethyl-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[[ethyl-[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-oxo-ethyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[[ethyl-[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-oxoethyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[[ethyl-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxoethyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[[ethyl-[2-keto-2-[4-(2-naphthylsulfonyl)piperazino]ethyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C29H33N5O6S MolecularWeight: 579.66722

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C29H33N5O6S/c1-4-32(18-27-30-24-17-26(40-3)25(39-2)16-23(24)29(36)31-27)19-28(35)33-11-13-34(14-12-33)41(37,38)22-10-9-20-7-5-6-8-21(20)15-22/h5-10,15-17H,4,11-14,18-19H2,1-3H3,(H,30,31,36)