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

Systemtic Name: 2-(4-methylpiperazin-1-yl)sulfonyl-3-piperidin-1-yl-naphthalene-1,4-dione Openeye Name: 2-(4-methylpiperazin-1-yl)sulfonyl-3-(1-piperidyl)naphthalene-1,4-dione CAS Name: 2-[(4-methyl-1-piperazinyl)sulfonyl]-3-(1-piperidinyl)naphthalene-1,4-dione IUPAC Name: 2-(4-methylpiperazin-1-yl)sulfonyl-3-piperidin-1-ylnaphthalene-1,4-dione Traditional Name: 2-(4-methylpiperazino)sulfonyl-3-piperidino-1,4-naphthoquinone Formula: C20H25N3O4S MolecularWeight: 403.4952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCCC4

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCCC4

InChI

InChI=1S/C20H25N3O4S/c1-21-11-13-23(14-12-21)28(26,27)20-17(22-9-5-2-6-10-22)18(24)15-7-3-4-8-16(15)19(20)25/h3-4,7-8H,2,5-6,9-14H2,1H3