2-[4-(diphenylmethyl)piperazin-1-yl]sulfonyl-3-(dipropylamino)naphthalene-1,4-dione

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]sulfonyl-3-(dipropylamino)naphthalene-1,4-dione Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)sulfonyl-3-(dipropylamino)naphthalene-1,4-dione CAS Name: 2-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]-3-(dipropylamino)naphthalene-1,4-dione IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)sulfonyl-3-(dipropylamino)naphthalene-1,4-dione Traditional Name: 2-(4-benzhydrylpiperazino)sulfonyl-3-(dipropylamino)-1,4-naphthoquinone Formula: C33H37N3O4S MolecularWeight: 571.72958

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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(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCN(CCC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H37N3O4S/c1-3-19-34(20-4-2)30-31(37)27-17-11-12-18-28(27)32(38)33(30)41(39,40)36-23-21-35(22-24-36)29(25-13-7-5-8-14-25)26-15-9-6-10-16-26/h5-18,29H,3-4,19-24H2,1-2H3