N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-5-(piperidin-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-5-(piperidin-1-ylmethyl)furan-2-carboxamide Openeye Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-5-(1-piperidylmethyl)furan-2-carboxamide CAS Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-5-(1-piperidinylmethyl)-2-furancarboxamide IUPAC Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-5-(piperidin-1-ylmethyl)furan-2-carboxamide Traditional Name: N-[4-bromo-1-(2-chlorobenzyl)pyrazol-3-yl]-5-(piperidinomethyl)-2-furamide Formula: C21H22BrClN4O2 MolecularWeight: 477.78198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(O2)C(=O)NC3=NN(C=C3Br)CC4=CC=CC=C4Cl

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(O2)C(=O)NC3=NN(C=C3Br)CC4=CC=CC=C4Cl

InChI

InChI=1S/C21H22BrClN4O2/c22-17-14-27(12-15-6-2-3-7-18(15)23)25-20(17)24-21(28)19-9-8-16(29-19)13-26-10-4-1-5-11-26/h2-3,6-9,14H,1,4-5,10-13H2,(H,24,25,28)