4-[(5-chloranylthiophen-2-yl)methyl]-N-(phenylmethyl)-1-pyridin-3-ylcarbonyl-piperazine-2-carboxamide

Systemtic Name: 4-[(5-chloranylthiophen-2-yl)methyl]-N-(phenylmethyl)-1-pyridin-3-ylcarbonyl-piperazine-2-carboxamide Openeye Name: N-benzyl-4-[(5-chloro-2-thienyl)methyl]-1-(pyridine-3-carbonyl)piperazine-2-carboxamide CAS Name: 4-[(5-chloro-2-thiophenyl)methyl]-1-[oxo(3-pyridinyl)methyl]-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: N-benzyl-4-[(5-chlorothiophen-2-yl)methyl]-1-(pyridine-3-carbonyl)piperazine-2-carboxamide Traditional Name: N-benzyl-4-[(5-chloro-2-thienyl)methyl]-1-nicotinoyl-piperazine-2-carboxamide Formula: C23H23ClN4O2S MolecularWeight: 454.97232

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CC2=CC=C(S2)Cl)C(=O)NCC3=CC=CC=C3)C(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(C(CN1CC2=CC=C(S2)Cl)C(=O)NCC3=CC=CC=C3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C23H23ClN4O2S/c24-21-9-8-19(31-21)15-27-11-12-28(23(30)18-7-4-10-25-14-18)20(16-27)22(29)26-13-17-5-2-1-3-6-17/h1-10,14,20H,11-13,15-16H2,(H,26,29)