N-(2,4-dimethylphenyl)-1-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide

Systemtic Name: N-(2,4-dimethylphenyl)-1-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Openeye Name: N-(2,4-dimethylphenyl)-1-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide CAS Name: N-(2,4-dimethylphenyl)-1-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(2,4-dimethylphenyl)-1-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Traditional Name: N-(2,4-dimethylphenyl)-1-[(2-keto-3H-1,3-benzoxazol-6-yl)sulfonyl]nipecotamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)O4)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)O4)C

InChI

InChI=1S/C21H23N3O5S/c1-13-5-7-17(14(2)10-13)22-20(25)15-4-3-9-24(12-15)30(27,28)16-6-8-18-19(11-16)29-21(26)23-18/h5-8,10-11,15H,3-4,9,12H2,1-2H3,(H,22,25)(H,23,26)