3-(3-bromanyl-4-methoxy-phenyl)-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3-bromanyl-4-methoxy-phenyl)-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(3-bromo-4-methoxy-phenyl)-1-[4-(2-thienylmethyl)piperazin-1-yl]propan-1-one CAS Name: 3-(3-bromo-4-methoxyphenyl)-1-[4-(thiophen-2-ylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(3-bromo-4-methoxyphenyl)-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(3-bromo-4-methoxy-phenyl)-1-[4-(2-thenyl)piperazino]propan-1-one Formula: C19H23BrN2O2S MolecularWeight: 423.36712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)CC3=CC=CS3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)CC3=CC=CS3)Br

InChI

InChI=1S/C19H23BrN2O2S/c1-24-18-6-4-15(13-17(18)20)5-7-19(23)22-10-8-21(9-11-22)14-16-3-2-12-25-16/h2-4,6,12-13H,5,7-11,14H2,1H3