1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide

Systemtic Name: 1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide Openeye Name: 1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)-N-(2-thienylmethyl)piperidine-3-carboxamide CAS Name: 1-[oxo-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]-N-(thiophen-2-ylmethyl)-3-piperidinecarboxamide IUPAC Name: 1-(1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide Traditional Name: 1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)-N-(2-thenyl)nipecotamide Formula: C25H25N5O2S MolecularWeight: 459.5633

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4)C(=O)NCC5=CC=CS5

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4)C(=O)NCC5=CC=CS5

InChI

InChI=1S/C25H25N5O2S/c31-23(26-16-21-11-7-15-33-21)19-8-6-14-29(18-19)25(32)22-17-27-30(20-9-2-1-3-10-20)24(22)28-12-4-5-13-28/h1-5,7,9-13,15,17,19H,6,8,14,16,18H2,(H,26,31)