3-[5-[(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[5-[(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[5-[(6-chloro-7-ethyl-2-oxo-chromen-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[5-[(6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methylthio]-4-methyl-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[5-[(6-chloro-7-ethyl-2-oxochromen-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[5-[(6-chloro-7-ethyl-2-keto-chromen-4-yl)methylthio]-4-methyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Formula: C25H27ClN4O4S2 MolecularWeight: 547.08928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(N3C)C4=CC(=CC=C4)S(=O)(=O)N(CC)CC)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(N3C)C4=CC(=CC=C4)S(=O)(=O)N(CC)CC)Cl

InChI

InChI=1S/C25H27ClN4O4S2/c1-5-16-12-22-20(14-21(16)26)18(13-23(31)34-22)15-35-25-28-27-24(29(25)4)17-9-8-10-19(11-17)36(32,33)30(6-2)7-3/h8-14H,5-7,15H2,1-4H3