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

Systemtic Name: 2-(dipropylamino)-3-(4-ethylpiperazin-1-yl)sulfonyl-naphthalene-1,4-dione Openeye Name: 2-(dipropylamino)-3-(4-ethylpiperazin-1-yl)sulfonyl-naphthalene-1,4-dione CAS Name: 2-(dipropylamino)-3-[(4-ethyl-1-piperazinyl)sulfonyl]naphthalene-1,4-dione IUPAC Name: 2-(dipropylamino)-3-(4-ethylpiperazin-1-yl)sulfonylnaphthalene-1,4-dione Traditional Name: 2-(dipropylamino)-3-(4-ethylpiperazino)sulfonyl-1,4-naphthoquinone Formula: C22H31N3O4S MolecularWeight: 433.56424

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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)CC

Isomeric SMILES

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

InChI

InChI=1S/C22H31N3O4S/c1-4-11-24(12-5-2)19-20(26)17-9-7-8-10-18(17)21(27)22(19)30(28,29)25-15-13-23(6-3)14-16-25/h7-10H,4-6,11-16H2,1-3H3