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

Systemtic Name: 2-(dipropylamino)-3-(4-methylpiperazin-1-yl)sulfonyl-naphthalene-1,4-dione Openeye Name: 2-(dipropylamino)-3-(4-methylpiperazin-1-yl)sulfonyl-naphthalene-1,4-dione CAS Name: 2-(dipropylamino)-3-[(4-methyl-1-piperazinyl)sulfonyl]naphthalene-1,4-dione IUPAC Name: 2-(dipropylamino)-3-(4-methylpiperazin-1-yl)sulfonylnaphthalene-1,4-dione Traditional Name: 2-(dipropylamino)-3-(4-methylpiperazino)sulfonyl-1,4-naphthoquinone Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CCCN(CCC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C21H29N3O4S/c1-4-10-23(11-5-2)18-19(25)16-8-6-7-9-17(16)20(26)21(18)29(27,28)24-14-12-22(3)13-15-24/h6-9H,4-5,10-15H2,1-3H3