(4-methylphenyl)methyl-[2-[(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (4-methylphenyl)methyl-[2-[(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-anilino)-2-oxo-ethyl]-(p-tolylmethyl)ammonium CAS Name: (4-methylphenyl)methyl-[2-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)anilino]-2-oxoethyl]ammonium IUPAC Name: (4-methylphenyl)methyl-[2-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylanilino)-2-oxoethyl]azanium Traditional Name: [2-keto-2-(5-morpholinosulfonyl-2-pyrrolidino-anilino)ethyl]-(4-methylbenzyl)ammonium Formula: C24H33N4O4S+ MolecularWeight: 473.60822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH2+]CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C[NH2+]CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4

InChI

InChI=1S/C24H32N4O4S/c1-19-4-6-20(7-5-19)17-25-18-24(29)26-22-16-21(8-9-23(22)27-10-2-3-11-27)33(30,31)28-12-14-32-15-13-28/h4-9,16,25H,2-3,10-15,17-18H2,1H3,(H,26,29)/p+1