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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)CCNC(=O)C4=CC=CS4

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)CCNC(=O)C4=CC=CS4

InChI

InChI=1S/C21H25N3O3S/c25-20(5-7-22-21(26)19-2-1-13-28-19)24-10-8-23(9-11-24)15-16-3-4-18-17(14-16)6-12-27-18/h1-4,13-14H,5-12,15H2,(H,22,26)