(2R)-5-chloranyl-N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: (2R)-5-chloranyl-N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: (2R)-5-chloro-N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: (2R)-5-chloro-N-[4-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: (2R)-5-chloro-N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: (2R)-5-chloro-N-[4-(4-ethylpiperazino)sulfonylphenyl]coumaran-2-carboxamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@H]3CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C21H24ClN3O4S/c1-2-24-9-11-25(12-10-24)30(27,28)18-6-4-17(5-7-18)23-21(26)20-14-15-13-16(22)3-8-19(15)29-20/h3-8,13,20H,2,9-12,14H2,1H3,(H,23,26)/t20-/m1/s1