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

Systemtic Name: N-[3-chloranyl-4-(2-methylpropoxy)phenyl]-1-thiophen-3-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-isobutoxy-phenyl)-1-(thiophene-3-carbonyl)piperidine-4-carboxamide CAS Name: N-[3-chloro-4-(2-methylpropoxy)phenyl]-1-[oxo(3-thiophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[3-chloro-4-(2-methylpropoxy)phenyl]-1-(thiophene-3-carbonyl)piperidine-4-carboxamide Traditional Name: N-(3-chloro-4-isobutoxy-phenyl)-1-(3-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=CSC=C3)Cl

Isomeric SMILES

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

InChI

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