5-[(2S)-1-[(2-methyl-1H-imidazol-3-ium-5-yl)methyl]pyrrolidin-1-ium-2-yl]-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide

Systemtic Name: 5-[(2S)-1-[(2-methyl-1H-imidazol-3-ium-5-yl)methyl]pyrrolidin-1-ium-2-yl]-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide Openeye Name: 5-[(2S)-1-[(2-methyl-1H-imidazol-3-ium-5-yl)methyl]pyrrolidin-1-ium-2-yl]-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide CAS Name: 5-[(2S)-1-[(2-methyl-1H-imidazol-3-ium-5-yl)methyl]-2-pyrrolidin-1-iumyl]-N-(1-methyl-4-pyrazolyl)-2-thiophenecarboxamide IUPAC Name: 5-[(2S)-1-[(2-methyl-1H-imidazol-3-ium-5-yl)methyl]pyrrolidin-1-ium-2-yl]-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide Traditional Name: 5-[(2S)-1-[(2-methyl-1H-imidazol-3-ium-5-yl)methyl]pyrrolidin-1-ium-2-yl]-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide Formula: C18H24N6OS+2 MolecularWeight: 372.48776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C=C(N1)C[NH+]2CCCC2C3=CC=C(S3)C(=O)NC4=CN(N=C4)C

Isomeric SMILES

CC1=[NH+]C=C(N1)C[NH+]2CCC[C@H]2C3=CC=C(S3)C(=O)NC4=CN(N=C4)C

InChI

InChI=1S/C18H22N6OS/c1-12-19-8-13(21-12)11-24-7-3-4-15(24)16-5-6-17(26-16)18(25)22-14-9-20-23(2)10-14/h5-6,8-10,15H,3-4,7,11H2,1-2H3,(H,19,21)(H,22,25)/p+2/t15-/m0/s1