N1,N1,N3,N3-tetraethyl-4-(4-methylpiperazin-1-yl)-6-(3-phenylpropylamino)benzene-1,3-disulfonamide

Systemtic Name: N1,N1,N3,N3-tetraethyl-4-(4-methylpiperazin-1-yl)-6-(3-phenylpropylamino)benzene-1,3-disulfonamide Openeye Name: N1,N1,N3,N3-tetraethyl-4-(4-methylpiperazin-1-yl)-6-(3-phenylpropylamino)benzene-1,3-disulfonamide CAS Name: N1,N1,N3,N3-tetraethyl-4-(4-methyl-1-piperazinyl)-6-(3-phenylpropylamino)benzene-1,3-disulfonamide IUPAC Name: 1-N,1-N,3-N,3-N-tetraethyl-4-(4-methylpiperazin-1-yl)-6-(3-phenylpropylamino)benzene-1,3-disulfonamide Traditional Name: N,N,N',N'-tetraethyl-4-(4-methylpiperazino)-6-(3-phenylpropylamino)benzene-1,3-disulfonamide Formula: C28H45N5O4S2 MolecularWeight: 579.818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1N2CCN(CC2)C)NCCCC3=CC=CC=C3)S(=O)(=O)N(CC)CC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1N2CCN(CC2)C)NCCCC3=CC=CC=C3)S(=O)(=O)N(CC)CC

InChI

InChI=1S/C28H45N5O4S2/c1-6-32(7-2)38(34,35)27-23-28(39(36,37)33(8-3)9-4)26(31-20-18-30(5)19-21-31)22-25(27)29-17-13-16-24-14-11-10-12-15-24/h10-12,14-15,22-23,29H,6-9,13,16-21H2,1-5H3