N-[5-[2-(4-methylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide

Systemtic Name: N-[5-[2-(4-methylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide Openeye Name: 3-phenyl-N-[5-[2-(p-tolylsulfonyl)ethyl]-1,3,4-thiadiazol-2-yl]propanamide CAS Name: N-[5-[2-(4-methylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide IUPAC Name: N-[5-[2-(4-methylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide Traditional Name: 3-phenyl-N-[5-(2-tosylethyl)-1,3,4-thiadiazol-2-yl]propionamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC2=NN=C(S2)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC2=NN=C(S2)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O3S2/c1-15-7-10-17(11-8-15)28(25,26)14-13-19-22-23-20(27-19)21-18(24)12-9-16-5-3-2-4-6-16/h2-8,10-11H,9,12-14H2,1H3,(H,21,23,24)