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

Systemtic Name: N-[4-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]carbonylphenyl]thiophene-2-carboxamide Openeye Name: N-[4-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[4-(coumaran-5-ylmethyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)NC(=O)C5=CC=CS5

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)NC(=O)C5=CC=CS5

InChI

InChI=1S/C25H25N3O3S/c29-24(23-2-1-15-32-23)26-21-6-4-19(5-7-21)25(30)28-12-10-27(11-13-28)17-18-3-8-22-20(16-18)9-14-31-22/h1-8,15-16H,9-14,17H2,(H,26,29)