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

Systemtic Name: N,N-diethyl-3-[5-ethylsulfanyl-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]benzenesulfonamide Openeye Name: N,N-diethyl-3-[5-ethylsulfanyl-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]benzenesulfonamide CAS Name: N,N-diethyl-3-[5-(ethylthio)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[5-ethylsulfanyl-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[5-(ethylthio)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]benzenesulfonamide Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2C3=CC(=CC=C3)OC)SCC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2C3=CC(=CC=C3)OC)SCC

InChI

InChI=1S/C21H26N4O3S2/c1-5-24(6-2)30(26,27)19-13-8-10-16(14-19)20-22-23-21(29-7-3)25(20)17-11-9-12-18(15-17)28-4/h8-15H,5-7H2,1-4H3