dimethyl-[2-[6-methyl-3-[methyl(thiophen-3-ylmethyl)carbamoyl]-4-oxidanylidene-2-phenethyl-pyridin-1-yl]ethyl]azanium

Systemtic Name: dimethyl-[2-[6-methyl-3-[methyl(thiophen-3-ylmethyl)carbamoyl]-4-oxidanylidene-2-phenethyl-pyridin-1-yl]ethyl]azanium Openeye Name: dimethyl-[2-[6-methyl-3-[methyl(3-thienylmethyl)carbamoyl]-4-oxo-2-phenethyl-1-pyridyl]ethyl]ammonium CAS Name: dimethyl-[2-[6-methyl-3-[[methyl(3-thiophenylmethyl)amino]-oxomethyl]-4-oxo-2-phenethyl-1-pyridinyl]ethyl]ammonium IUPAC Name: dimethyl-[2-[6-methyl-3-[methyl(thiophen-3-ylmethyl)carbamoyl]-4-oxo-2-phenethylpyridin-1-yl]ethyl]azanium Traditional Name: 2-[4-keto-6-methyl-3-[methyl(3-thenyl)carbamoyl]-2-phenethyl-1-pyridyl]ethyl-dimethyl-ammonium Formula: C25H32N3O2S+ MolecularWeight: 438.60548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1CC[NH+](C)C)CCC2=CC=CC=C2)C(=O)N(C)CC3=CSC=C3

Isomeric SMILES

CC1=CC(=O)C(=C(N1CC[NH+](C)C)CCC2=CC=CC=C2)C(=O)N(C)CC3=CSC=C3

InChI

InChI=1S/C25H31N3O2S/c1-19-16-23(29)24(25(30)27(4)17-21-12-15-31-18-21)22(28(19)14-13-26(2)3)11-10-20-8-6-5-7-9-20/h5-9,12,15-16,18H,10-11,13-14,17H2,1-4H3/p+1