N-[[1-[2-(benzotriazol-2-yl)ethanoyl]piperidin-3-yl]methyl]thiophene-2-sulfonamide

Systemtic Name: N-[[1-[2-(benzotriazol-2-yl)ethanoyl]piperidin-3-yl]methyl]thiophene-2-sulfonamide Openeye Name: N-[[1-[2-(benzotriazol-2-yl)acetyl]-3-piperidyl]methyl]thiophene-2-sulfonamide CAS Name: N-[[1-[2-(2-benzotriazolyl)-1-oxoethyl]-3-piperidinyl]methyl]-2-thiophenesulfonamide IUPAC Name: N-[[1-[2-(benzotriazol-2-yl)acetyl]piperidin-3-yl]methyl]thiophene-2-sulfonamide Traditional Name: N-[[1-[2-(benzotriazol-2-yl)acetyl]-3-piperidyl]methyl]thiophene-2-sulfonamide Formula: C18H21N5O3S2 MolecularWeight: 419.52104

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CN2N=C3C=CC=CC3=N2)CNS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CC(CN(C1)C(=O)CN2N=C3C=CC=CC3=N2)CNS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H21N5O3S2/c24-17(13-23-20-15-6-1-2-7-16(15)21-23)22-9-3-5-14(12-22)11-19-28(25,26)18-8-4-10-27-18/h1-2,4,6-8,10,14,19H,3,5,9,11-13H2