4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-(2,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)benzamide

Systemtic Name: 4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-(2,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)benzamide Openeye Name: 4-(3-oxopiperazin-1-yl)sulfonyl-N-(2,6,6-trimethyl-5,7-dihydro-4H-benzofuran-4-yl)benzamide CAS Name: 4-[(3-oxo-1-piperazinyl)sulfonyl]-N-(2,6,6-trimethyl-5,7-dihydro-4H-benzofuran-4-yl)benzamide IUPAC Name: 4-(3-oxopiperazin-1-yl)sulfonyl-N-(2,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)benzamide Traditional Name: 4-(3-ketopiperazino)sulfonyl-N-(2,6,6-trimethyl-5,7-dihydro-4H-benzofuran-4-yl)benzamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(O1)CC(CC2NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCNC(=O)C4)(C)C

Isomeric SMILES

CC1=CC2=C(O1)CC(CC2NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCNC(=O)C4)(C)C

InChI

InChI=1S/C22H27N3O5S/c1-14-10-17-18(11-22(2,3)12-19(17)30-14)24-21(27)15-4-6-16(7-5-15)31(28,29)25-9-8-23-20(26)13-25/h4-7,10,18H,8-9,11-13H2,1-3H3,(H,23,26)(H,24,27)