[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]-[(1S)-1-thiophen-2-ylethyl]azanium

Systemtic Name: [1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]-[(1S)-1-thiophen-2-ylethyl]azanium Openeye Name: [1-[4-(3-pyridylmethylcarbamoyl)phenyl]-4-piperidyl]-[(1S)-1-(2-thienyl)ethyl]ammonium CAS Name: [1-[4-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-4-piperidinyl]-[(1S)-1-thiophen-2-ylethyl]ammonium IUPAC Name: [1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]-[(1S)-1-thiophen-2-ylethyl]azanium Traditional Name: [1-[4-(3-pyridylmethylcarbamoyl)phenyl]-4-piperidyl]-[(1S)-1-(2-thienyl)ethyl]ammonium Formula: C24H29N4OS+ MolecularWeight: 421.57826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)[NH2+]C2CCN(CC2)C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C[C@@H](C1=CC=CS1)[NH2+]C2CCN(CC2)C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C24H28N4OS/c1-18(23-5-3-15-30-23)27-21-10-13-28(14-11-21)22-8-6-20(7-9-22)24(29)26-17-19-4-2-12-25-16-19/h2-9,12,15-16,18,21,27H,10-11,13-14,17H2,1H3,(H,26,29)/p+1/t18-/m0/s1