N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-2-(4-methylpiperazin-1-yl)-2-thiophen-2-yl-ethanamine

Systemtic Name: N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-2-(4-methylpiperazin-1-yl)-2-thiophen-2-yl-ethanamine Openeye Name: N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-2-(4-methylpiperazin-1-yl)-2-(2-thienyl)ethanamine CAS Name: N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-2-(4-methyl-1-piperazinyl)-2-thiophen-2-ylethanamine IUPAC Name: N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-2-(4-methylpiperazin-1-yl)-2-thiophen-2-ylethanamine Traditional Name: (5-ethoxy-2-methyl-coumaran-6-yl)methyl-[2-(4-methylpiperazino)-2-(2-thienyl)ethyl]amine Formula: C23H33N3O2S MolecularWeight: 415.59202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNCC(C3=CC=CS3)N4CCN(CC4)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CNCC(C3=CC=CS3)N4CCN(CC4)C

InChI

InChI=1S/C23H33N3O2S/c1-4-27-21-13-18-12-17(2)28-22(18)14-19(21)15-24-16-20(23-6-5-11-29-23)26-9-7-25(3)8-10-26/h5-6,11,13-14,17,20,24H,4,7-10,12,15-16H2,1-3H3