N-[1-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[1-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-[4-(coumaran-5-ylmethyl)piperazino]-2-keto-1-methyl-ethyl]thiophene-2-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCC3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCC3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C21H25N3O3S/c1-15(22-20(25)19-3-2-12-28-19)21(26)24-9-7-23(8-10-24)14-16-4-5-18-17(13-16)6-11-27-18/h2-5,12-13,15H,6-11,14H2,1H3,(H,22,25)