N-(furan-2-ylmethyl)-1-[1-(2-methoxyethyl)benzotriazol-5-yl]sulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-1-[1-(2-methoxyethyl)benzotriazol-5-yl]sulfonyl-piperidine-2-carboxamide Openeye Name: N-(2-furylmethyl)-1-[1-(2-methoxyethyl)benzotriazol-5-yl]sulfonyl-piperidine-2-carboxamide CAS Name: N-(2-furanylmethyl)-1-[[1-(2-methoxyethyl)-5-benzotriazolyl]sulfonyl]-2-piperidinecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-1-[1-(2-methoxyethyl)benzotriazol-5-yl]sulfonylpiperidine-2-carboxamide Traditional Name: N-(2-furfuryl)-1-[1-(2-methoxyethyl)benzotriazol-5-yl]sulfonyl-pipecolinamide Formula: C20H25N5O5S MolecularWeight: 447.508

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3C(=O)NCC4=CC=CO4)N=N1

Isomeric SMILES

COCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3C(=O)NCC4=CC=CO4)N=N1

InChI

InChI=1S/C20H25N5O5S/c1-29-12-10-24-18-8-7-16(13-17(18)22-23-24)31(27,28)25-9-3-2-6-19(25)20(26)21-14-15-5-4-11-30-15/h4-5,7-8,11,13,19H,2-3,6,9-10,12,14H2,1H3,(H,21,26)