3-[5-(2-azanylethylsulfanyl)-4-butan-2-yl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[5-(2-azanylethylsulfanyl)-4-butan-2-yl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[5-(2-aminoethylsulfanyl)-4-sec-butyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[5-(2-aminoethylthio)-4-butan-2-yl-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[5-(2-aminoethylsulfanyl)-4-butan-2-yl-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[5-(2-aminoethylthio)-4-sec-butyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Formula: C18H29N5O2S2 MolecularWeight: 411.58516

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=NN=C1SCCN)C2=CC(=CC=C2)S(=O)(=O)N(CC)CC

Isomeric SMILES

CCC(C)N1C(=NN=C1SCCN)C2=CC(=CC=C2)S(=O)(=O)N(CC)CC

InChI

InChI=1S/C18H29N5O2S2/c1-5-14(4)23-17(20-21-18(23)26-12-11-19)15-9-8-10-16(13-15)27(24,25)22(6-2)7-3/h8-10,13-14H,5-7,11-12,19H2,1-4H3