[3-methoxy-4-(3-methylbutoxy)phenyl]-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4S/c1-16(2)8-13-28-18-7-6-17(15-19(18)27-3)21(25)23-9-11-24(12-10-23)22(26)20-5-4-14-29-20/h4-7,14-16H,8-13H2,1-3H3