1-(4-methylphenyl)-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-methylphenyl)-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Openeye Name: 2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(p-tolyl)ethanone CAS Name: 1-(4-methylphenyl)-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-(4-methylphenyl)-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Traditional Name: 2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(p-tolyl)ethanone Formula: C14H15N3OS2 MolecularWeight: 305.4184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)NCC=C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)NCC=C

InChI

InChI=1S/C14H15N3OS2/c1-3-8-15-13-16-17-14(20-13)19-9-12(18)11-6-4-10(2)5-7-11/h3-7H,1,8-9H2,2H3,(H,15,16)