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

Systemtic Name: 2-(diethylamino)-3-(4-phenylpiperazin-1-yl)sulfonyl-naphthalene-1,4-dione Openeye Name: 2-(diethylamino)-3-(4-phenylpiperazin-1-yl)sulfonyl-naphthalene-1,4-dione CAS Name: 2-(diethylamino)-3-[(4-phenyl-1-piperazinyl)sulfonyl]naphthalene-1,4-dione IUPAC Name: 2-(diethylamino)-3-(4-phenylpiperazin-1-yl)sulfonylnaphthalene-1,4-dione Traditional Name: 2-(diethylamino)-3-(4-phenylpiperazino)sulfonyl-1,4-naphthoquinone Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N3O4S/c1-3-25(4-2)21-22(28)19-12-8-9-13-20(19)23(29)24(21)32(30,31)27-16-14-26(15-17-27)18-10-6-5-7-11-18/h5-13H,3-4,14-17H2,1-2H3