[(1S)-2-methyl-1-phenyl-propyl]-[2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [(1S)-2-methyl-1-phenyl-propyl]-[2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [(1S)-2-methyl-1-phenyl-propyl]-[2-[2-methyl-5-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]ammonium CAS Name: [(1S)-2-methyl-1-phenylpropyl]-[2-[2-methyl-5-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]ammonium IUPAC Name: [(1S)-2-methyl-1-phenylpropyl]-[2-(2-methyl-5-piperidin-1-ylsulfonylanilino)-2-oxoethyl]azanium Traditional Name: [2-keto-2-(2-methyl-5-piperidinosulfonyl-anilino)ethyl]-[(1S)-2-methyl-1-phenyl-propyl]ammonium Formula: C24H34N3O3S+ MolecularWeight: 444.61006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C[NH2+]C(C3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C[NH2+][C@H](C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C24H33N3O3S/c1-18(2)24(20-10-6-4-7-11-20)25-17-23(28)26-22-16-21(13-12-19(22)3)31(29,30)27-14-8-5-9-15-27/h4,6-7,10-13,16,18,24-25H,5,8-9,14-15,17H2,1-3H3,(H,26,28)/p+1/t24-/m0/s1