N,N-dimethyl-3-[5-oxidanylidene-1-(2-phenoxyethyl)-4-thiophen-2-yl-1,2,4-triazol-3-yl]piperidine-1-sulfonamide

Systemtic Name: N,N-dimethyl-3-[5-oxidanylidene-1-(2-phenoxyethyl)-4-thiophen-2-yl-1,2,4-triazol-3-yl]piperidine-1-sulfonamide Openeye Name: N,N-dimethyl-3-[5-oxo-1-(2-phenoxyethyl)-4-(2-thienyl)-1,2,4-triazol-3-yl]piperidine-1-sulfonamide CAS Name: N,N-dimethyl-3-[5-oxo-1-(2-phenoxyethyl)-4-thiophen-2-yl-1,2,4-triazol-3-yl]-1-piperidinesulfonamide IUPAC Name: N,N-dimethyl-3-[5-oxo-1-(2-phenoxyethyl)-4-thiophen-2-yl-1,2,4-triazol-3-yl]piperidine-1-sulfonamide Traditional Name: 3-[5-keto-1-(2-phenoxyethyl)-4-(2-thienyl)-1,2,4-triazol-3-yl]-N,N-dimethyl-piperidine-1-sulfonamide Formula: C21H27N5O4S2 MolecularWeight: 477.60018

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCCC(C1)C2=NN(C(=O)N2C3=CC=CS3)CCOC4=CC=CC=C4

Isomeric SMILES

CN(C)S(=O)(=O)N1CCCC(C1)C2=NN(C(=O)N2C3=CC=CS3)CCOC4=CC=CC=C4

InChI

InChI=1S/C21H27N5O4S2/c1-23(2)32(28,29)24-12-6-8-17(16-24)20-22-25(13-14-30-18-9-4-3-5-10-18)21(27)26(20)19-11-7-15-31-19/h3-5,7,9-11,15,17H,6,8,12-14,16H2,1-2H3