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

Systemtic Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-(2-phenylsulfanylethanoylamino)propanamide Openeye Name: N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]-2-[(2-phenylsulfanylacetyl)amino]propanamide CAS Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-[[1-oxo-2-(phenylthio)ethyl]amino]propanamide IUPAC Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-[(2-phenylsulfanylacetyl)amino]propanamide Traditional Name: N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]-2-[[2-(phenylthio)acetyl]amino]propionamide Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C(C)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C(C)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C20H20N4O2S2/c1-13-7-6-8-15(11-13)19-23-24-20(28-19)22-18(26)14(2)21-17(25)12-27-16-9-4-3-5-10-16/h3-11,14H,12H2,1-2H3,(H,21,25)(H,22,24,26)