N-[3-(benzimidazol-1-yl)propyl]-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-4-carboxamide

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-4-carboxamide Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(1-benzimidazolyl)propyl]-1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-4-carboxamide Traditional Name: N-[3-(benzimidazol-1-yl)propyl]-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-isonipecotamide Formula: C21H27N5O4S MolecularWeight: 445.53518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCCCN3C=NC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCCCN3C=NC4=CC=CC=C43

InChI

InChI=1S/C21H27N5O4S/c1-15-20(16(2)30-24-15)31(28,29)26-12-8-17(9-13-26)21(27)22-10-5-11-25-14-23-18-6-3-4-7-19(18)25/h3-4,6-7,14,17H,5,8-13H2,1-2H3,(H,22,27)