N-[5-(3,4-dichlorophenyl)carbonyl-2-nitro-phenyl]-5-methyl-1,3,4-thiadiazole-2-sulfonamide

Systemtic Name: N-[5-(3,4-dichlorophenyl)carbonyl-2-nitro-phenyl]-5-methyl-1,3,4-thiadiazole-2-sulfonamide Openeye Name: N-[5-(3,4-dichlorobenzoyl)-2-nitro-phenyl]-5-methyl-1,3,4-thiadiazole-2-sulfonamide CAS Name: N-[5-[(3,4-dichlorophenyl)-oxomethyl]-2-nitrophenyl]-5-methyl-1,3,4-thiadiazole-2-sulfonamide IUPAC Name: N-[5-(3,4-dichlorobenzoyl)-2-nitrophenyl]-5-methyl-1,3,4-thiadiazole-2-sulfonamide Traditional Name: N-[5-(3,4-dichlorobenzoyl)-2-nitro-phenyl]-5-methyl-1,3,4-thiadiazole-2-sulfonamide Formula: C16H10Cl2N4O5S2 MolecularWeight: 473.3104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)C3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(S1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)C3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H10Cl2N4O5S2/c1-8-19-20-16(28-8)29(26,27)21-13-7-10(3-5-14(13)22(24)25)15(23)9-2-4-11(17)12(18)6-9/h2-7,21H,1H3