3-[[(Z)-2-benzamido-3-[1-(dimethylsulfamoyl)indol-3-yl]prop-2-enoyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(Z)-2-benzamido-3-[1-(dimethylsulfamoyl)indol-3-yl]prop-2-enoyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(Z)-2-benzamido-3-[1-(dimethylsulfamoyl)indol-3-yl]prop-2-enoyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(Z)-2-benzamido-3-[1-(dimethylsulfamoyl)-3-indolyl]-1-oxoprop-2-enyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(Z)-2-benzamido-3-[1-(dimethylsulfamoyl)indol-3-yl]prop-2-enoyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(Z)-2-benzamido-3-[1-(dimethylsulfamoyl)indol-3-yl]acryloyl]amino]propyl-dimethyl-ammonium Formula: C25H32N5O4S+ MolecularWeight: 498.61768

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C(=CC1=CN(C2=CC=CC=C21)S(=O)(=O)N(C)C)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCCNC(=O)/C(=C/C1=CN(C2=CC=CC=C21)S(=O)(=O)N(C)C)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H31N5O4S/c1-28(2)16-10-15-26-25(32)22(27-24(31)19-11-6-5-7-12-19)17-20-18-30(35(33,34)29(3)4)23-14-9-8-13-21(20)23/h5-9,11-14,17-18H,10,15-16H2,1-4H3,(H,26,32)(H,27,31)/p+1/b22-17-