dimethyl-[(1S)-1-phenyl-2-[[3-(4-phenylpiperazin-1-yl)sulfonylphenyl]carbonylamino]ethyl]azanium

Systemtic Name: dimethyl-[(1S)-1-phenyl-2-[[3-(4-phenylpiperazin-1-yl)sulfonylphenyl]carbonylamino]ethyl]azanium Openeye Name: dimethyl-[(1S)-1-phenyl-2-[[3-(4-phenylpiperazin-1-yl)sulfonylbenzoyl]amino]ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[oxo-[3-[(4-phenyl-1-piperazinyl)sulfonyl]phenyl]methyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-1-phenyl-2-[[3-(4-phenylpiperazin-1-yl)sulfonylbenzoyl]amino]ethyl]azanium Traditional Name: dimethyl-[(1S)-1-phenyl-2-[[3-(4-phenylpiperazino)sulfonylbenzoyl]amino]ethyl]ammonium Formula: C27H33N4O3S+ MolecularWeight: 493.64092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H32N4O3S/c1-29(2)26(22-10-5-3-6-11-22)21-28-27(32)23-12-9-15-25(20-23)35(33,34)31-18-16-30(17-19-31)24-13-7-4-8-14-24/h3-15,20,26H,16-19,21H2,1-2H3,(H,28,32)/p+1/t26-/m1/s1