2-(1,2-benzoxazol-3-yl)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]ethanamide

Systemtic Name: 2-(1,2-benzoxazol-3-yl)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]ethanamide Openeye Name: 2-(1,2-benzoxazol-3-yl)-N-[[4-(1-piperidylsulfonyl)phenyl]methyl]acetamide CAS Name: 2-(1,2-benzoxazol-3-yl)-N-[[4-(1-piperidinylsulfonyl)phenyl]methyl]acetamide IUPAC Name: 2-(1,2-benzoxazol-3-yl)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]acetamide Traditional Name: 2-indoxazen-3-yl-N-(4-piperidinosulfonylbenzyl)acetamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CC3=NOC4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CC3=NOC4=CC=CC=C43

InChI

InChI=1S/C21H23N3O4S/c25-21(14-19-18-6-2-3-7-20(18)28-23-19)22-15-16-8-10-17(11-9-16)29(26,27)24-12-4-1-5-13-24/h2-3,6-11H,1,4-5,12-15H2,(H,22,25)