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

Systemtic Name: N-[2-(3-methylthiophen-2-yl)ethyl]-1-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Openeye Name: N-[2-(3-methyl-2-thienyl)ethyl]-1-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[2-(3-methyl-2-thiophenyl)ethyl]-1-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(3-methylthiophen-2-yl)ethyl]-1-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Traditional Name: 1-[(2-keto-3H-1,3-benzoxazol-6-yl)sulfonyl]-N-[2-(3-methyl-2-thienyl)ethyl]nipecotamide Formula: C20H23N3O5S2 MolecularWeight: 449.54372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O5S2/c1-13-7-10-29-18(13)6-8-21-19(24)14-3-2-9-23(12-14)30(26,27)15-4-5-16-17(11-15)28-20(25)22-16/h4-5,7,10-11,14H,2-3,6,8-9,12H2,1H3,(H,21,24)(H,22,25)