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

Systemtic Name: N-(4-methylphenyl)-2-[[5-(2-phenoxyethanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Openeye Name: 2-[[5-[(2-phenoxyacetyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(p-tolyl)propanamide CAS Name: N-(4-methylphenyl)-2-[[5-[(1-oxo-2-phenoxyethyl)amino]-1,3,4-thiadiazol-2-yl]thio]propanamide IUPAC Name: N-(4-methylphenyl)-2-[[5-[(2-phenoxyacetyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Traditional Name: 2-[[5-[(2-phenoxyacetyl)amino]-1,3,4-thiadiazol-2-yl]thio]-N-(p-tolyl)propionamide Formula: C20H20N4O3S2 MolecularWeight: 428.5278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)SC2=NN=C(S2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C)SC2=NN=C(S2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C20H20N4O3S2/c1-13-8-10-15(11-9-13)21-18(26)14(2)28-20-24-23-19(29-20)22-17(25)12-27-16-6-4-3-5-7-16/h3-11,14H,12H2,1-2H3,(H,21,26)(H,22,23,25)