2-[[5-[(3-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-prop-2-ynyl-ethanamide

Systemtic Name: 2-[[5-[(3-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-prop-2-ynyl-ethanamide Openeye Name: 2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-prop-2-ynyl-acetamide CAS Name: 2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]thio]-N-prop-2-ynylacetamide IUPAC Name: 2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-prop-2-ynylacetamide Traditional Name: 2-[[5-(m-toluidino)-1,3,4-thiadiazol-2-yl]thio]-N-propargyl-acetamide Formula: C14H14N4OS2 MolecularWeight: 318.41716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC(=O)NCC#C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC(=O)NCC#C

InChI

InChI=1S/C14H14N4OS2/c1-3-7-15-12(19)9-20-14-18-17-13(21-14)16-11-6-4-5-10(2)8-11/h1,4-6,8H,7,9H2,2H3,(H,15,19)(H,16,17)