[3-ethoxy-4-(2-methylpropoxy)phenyl]-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone

Systemtic Name: [3-ethoxy-4-(2-methylpropoxy)phenyl]-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone Openeye Name: (3-ethoxy-4-isobutoxy-phenyl)-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone CAS Name: [3-ethoxy-4-(2-methylpropoxy)phenyl]-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methanone IUPAC Name: [3-ethoxy-4-(2-methylpropoxy)phenyl]-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone Traditional Name: (3-ethoxy-4-isobutoxy-phenyl)-[4-(2-thenoyl)piperazino]methanone Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CS3)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CS3)OCC(C)C

InChI

InChI=1S/C22H28N2O4S/c1-4-27-19-14-17(7-8-18(19)28-15-16(2)3)21(25)23-9-11-24(12-10-23)22(26)20-6-5-13-29-20/h5-8,13-14,16H,4,9-12,15H2,1-3H3