1-(4-chlorophenyl)-6-methyl-4-oxidanylidene-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]pyridazine-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-6-methyl-4-oxidanylidene-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]pyridazine-3-carboxamide Openeye Name: 1-(4-chlorophenyl)-6-methyl-4-oxo-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]pyridazine-3-carboxamide CAS Name: 1-(4-chlorophenyl)-6-methyl-4-oxo-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]-3-pyridazinecarboxamide IUPAC Name: 1-(4-chlorophenyl)-6-methyl-4-oxo-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]pyridazine-3-carboxamide Traditional Name: 1-(4-chlorophenyl)-4-keto-6-methyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]pyridazine-3-carboxamide Formula: C22H24ClN4O2S+ MolecularWeight: 443.96956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=C(C=C2)Cl)C(=O)NCC(C3=CC=CS3)[NH+]4CCCC4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=C(C=C2)Cl)C(=O)NC[C@@H](C3=CC=CS3)[NH+]4CCCC4

InChI

InChI=1S/C22H23ClN4O2S/c1-15-13-19(28)21(25-27(15)17-8-6-16(23)7-9-17)22(29)24-14-18(20-5-4-12-30-20)26-10-2-3-11-26/h4-9,12-13,18H,2-3,10-11,14H2,1H3,(H,24,29)/p+1/t18-/m0/s1