N-(6-methyl-1,3-benzothiazol-2-yl)-1-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-1-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Traditional Name: 1-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonyl]-N-(6-methyl-1,3-benzothiazol-2-yl)nipecotamide Formula: C22H22N4O5S2 MolecularWeight: 486.56388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC5=C(C=C4)N(C(=O)O5)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC5=C(C=C4)N(C(=O)O5)C

InChI

InChI=1S/C22H22N4O5S2/c1-13-5-7-16-19(10-13)32-21(23-16)24-20(27)14-4-3-9-26(12-14)33(29,30)15-6-8-17-18(11-15)31-22(28)25(17)2/h5-8,10-11,14H,3-4,9,12H2,1-2H3,(H,23,24,27)