5-[(2S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: 5-[(2S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: 5-[(2S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: 5-[(2S)-1-[(3-methyl-1-propyl-4-pyrazolyl)methyl]-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: 5-[(2S)-1-[(3-methyl-1-propylpyrazol-4-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: 5-[(2S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C17H25N4OS+ MolecularWeight: 333.4716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=N1)C)C[NH+]2CCCC2C3=CC=C(S3)C(=O)N

Isomeric SMILES

CCCN1C=C(C(=N1)C)C[NH+]2CCC[C@H]2C3=CC=C(S3)C(=O)N

InChI

InChI=1S/C17H24N4OS/c1-3-8-21-11-13(12(2)19-21)10-20-9-4-5-14(20)15-6-7-16(23-15)17(18)22/h6-7,11,14H,3-5,8-10H2,1-2H3,(H2,18,22)/p+1/t14-/m0/s1