N-[3-chloranyl-4-(2-methylpropoxy)phenyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-chloranyl-4-(2-methylpropoxy)phenyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-isobutoxy-phenyl)-1-(thiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-[3-chloro-4-(2-methylpropoxy)phenyl]-1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[3-chloro-4-(2-methylpropoxy)phenyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-(3-chloro-4-isobutoxy-phenyl)-1-(2-thenoyl)isonipecotamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC=CS3)Cl

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC=CS3)Cl

InChI

InChI=1S/C21H25ClN2O3S/c1-14(2)13-27-18-6-5-16(12-17(18)22)23-20(25)15-7-9-24(10-8-15)21(26)19-4-3-11-28-19/h3-6,11-12,14-15H,7-10,13H2,1-2H3,(H,23,25)