[4-(2-pyrazol-1-ylethyl)piperidin-1-yl]-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]methanone

Systemtic Name: [4-(2-pyrazol-1-ylethyl)piperidin-1-yl]-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]methanone Openeye Name: [4-(2-pyrazol-1-ylethyl)-1-piperidyl]-[5-[(2R)-pyrrolidin-1-ium-2-yl]-2-thienyl]methanone CAS Name: [4-[2-(1-pyrazolyl)ethyl]-1-piperidinyl]-[5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenyl]methanone IUPAC Name: [4-(2-pyrazol-1-ylethyl)piperidin-1-yl]-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]methanone Traditional Name: [4-(2-pyrazol-1-ylethyl)piperidino]-[5-[(2R)-pyrrolidin-1-ium-2-yl]-2-thienyl]methanone Formula: C19H27N4OS+ MolecularWeight: 359.50888

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C2=CC=C(S2)C(=O)N3CCC(CC3)CCN4C=CC=N4

Isomeric SMILES

C1C[C@@H]([NH2+]C1)C2=CC=C(S2)C(=O)N3CCC(CC3)CCN4C=CC=N4

InChI

InChI=1S/C19H26N4OS/c24-19(18-5-4-17(25-18)16-3-1-9-20-16)22-12-6-15(7-13-22)8-14-23-11-2-10-21-23/h2,4-5,10-11,15-16,20H,1,3,6-9,12-14H2/p+1/t16-/m1/s1