N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C16H23N4OS+ MolecularWeight: 319.44502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CCNC(=O)C2=CC=C(S2)C3CCC[NH2+]3

Isomeric SMILES

CC1=C(C(=NN1)C)CCNC(=O)C2=CC=C(S2)[C@H]3CCC[NH2+]3

InChI

InChI=1S/C16H22N4OS/c1-10-12(11(2)20-19-10)7-9-18-16(21)15-6-5-14(22-15)13-4-3-8-17-13/h5-6,13,17H,3-4,7-9H2,1-2H3,(H,18,21)(H,19,20)/p+1/t13-/m1/s1