N-[5-[2-(3,4-dimethylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[5-[2-(3,4-dimethylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide Openeye Name: N-[5-[2-(3,4-dimethylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide CAS Name: N-[5-[2-(3,4-dimethylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide IUPAC Name: N-[5-[2-(3,4-dimethylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide Traditional Name: N-[5-[2-(3,4-dimethylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide Formula: C19H25N3O3S2 MolecularWeight: 407.5501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)CCC2=NN=C(S2)NC(=O)C3CCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)CCC2=NN=C(S2)NC(=O)C3CCCCC3)C

InChI

InChI=1S/C19H25N3O3S2/c1-13-8-9-16(12-14(13)2)27(24,25)11-10-17-21-22-19(26-17)20-18(23)15-6-4-3-5-7-15/h8-9,12,15H,3-7,10-11H2,1-2H3,(H,20,22,23)