3-chloranyl-2-methyl-N-[5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide

Systemtic Name: 3-chloranyl-2-methyl-N-[5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide Openeye Name: 3-chloro-2-methyl-N-[5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide CAS Name: 3-chloro-2-methyl-N-[5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide IUPAC Name: 3-chloro-2-methyl-N-[5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide Traditional Name: 3-chloro-2-methyl-N-[5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]benzenesulfonamide Formula: C16H13ClN4O5S2 MolecularWeight: 440.88122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)S(=O)(=O)NC2=NN=C(S2)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)S(=O)(=O)NC2=NN=C(S2)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13ClN4O5S2/c1-10-13(17)3-2-4-14(10)28(24,25)20-16-19-18-15(27-16)9-26-12-7-5-11(6-8-12)21(22)23/h2-8H,9H2,1H3,(H,19,20)