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

Systemtic Name: 2-(dipropylamino)-3-(4-phenylpiperazin-1-yl)sulfonyl-naphthalene-1,4-dione Openeye Name: 2-(dipropylamino)-3-(4-phenylpiperazin-1-yl)sulfonyl-naphthalene-1,4-dione CAS Name: 2-(dipropylamino)-3-[(4-phenyl-1-piperazinyl)sulfonyl]naphthalene-1,4-dione IUPAC Name: 2-(dipropylamino)-3-(4-phenylpiperazin-1-yl)sulfonylnaphthalene-1,4-dione Traditional Name: 2-(dipropylamino)-3-(4-phenylpiperazino)sulfonyl-1,4-naphthoquinone Formula: C26H31N3O4S MolecularWeight: 481.60704

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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)C4=CC=CC=C4

Isomeric SMILES

CCCN(CCC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H31N3O4S/c1-3-14-28(15-4-2)23-24(30)21-12-8-9-13-22(21)25(31)26(23)34(32,33)29-18-16-27(17-19-29)20-10-6-5-7-11-20/h5-13H,3-4,14-19H2,1-2H3