N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-1-benzyl-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-1-benzyl-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-1-benzyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)CC(=O)N

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)CC(=O)N

InChI

InChI=1S/C22H25N5O2S/c23-20(28)15-26-10-8-17(9-11-26)24-22(29)18-14-27(13-16-5-2-1-3-6-16)25-21(18)19-7-4-12-30-19/h1-7,12,14,17H,8-11,13,15H2,(H2,23,28)(H,24,29)