methyl-[(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl]-[(1-phenylpyrazol-4-yl)methyl]azanium

Systemtic Name: methyl-[(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl]-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: methyl-[(1R)-1-methyl-2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl]-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: methyl-[(2R)-1-oxo-1-[4-(1-pyrrolidinylsulfonyl)anilino]propan-2-yl]-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: methyl-[(2R)-1-oxo-1-(4-pyrrolidin-1-ylsulfonylanilino)propan-2-yl]-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: [(1R)-2-keto-1-methyl-2-(4-pyrrolidinosulfonylanilino)ethyl]-methyl-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C24H30N5O3S+ MolecularWeight: 468.5917

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)[NH+](C)CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)[NH+](C)CC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H29N5O3S/c1-19(27(2)17-20-16-25-29(18-20)22-8-4-3-5-9-22)24(30)26-21-10-12-23(13-11-21)33(31,32)28-14-6-7-15-28/h3-5,8-13,16,18-19H,6-7,14-15,17H2,1-2H3,(H,26,30)/p+1/t19-/m1/s1