2-(4-methylpiperazin-1-yl)sulfonyl-3-(4-methylpiperidin-1-yl)naphthalene-1,4-dione

Systemtic Name: 2-(4-methylpiperazin-1-yl)sulfonyl-3-(4-methylpiperidin-1-yl)naphthalene-1,4-dione Openeye Name: 2-(4-methylpiperazin-1-yl)sulfonyl-3-(4-methyl-1-piperidyl)naphthalene-1,4-dione CAS Name: 2-[(4-methyl-1-piperazinyl)sulfonyl]-3-(4-methyl-1-piperidinyl)naphthalene-1,4-dione IUPAC Name: 2-(4-methylpiperazin-1-yl)sulfonyl-3-(4-methylpiperidin-1-yl)naphthalene-1,4-dione Traditional Name: 2-(4-methylpiperazino)sulfonyl-3-(4-methylpiperidino)-1,4-naphthoquinone Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)N4CCN(CC4)C

Isomeric SMILES

CC1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)N4CCN(CC4)C

InChI

InChI=1S/C21H27N3O4S/c1-15-7-9-23(10-8-15)18-19(25)16-5-3-4-6-17(16)20(26)21(18)29(27,28)24-13-11-22(2)12-14-24/h3-6,15H,7-14H2,1-2H3