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

Systemtic Name: 1-(4-methylphenyl)-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one Openeye Name: 2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(p-tolyl)propan-1-one CAS Name: 1-(4-methylphenyl)-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]thio]-1-propanone IUPAC Name: 1-(4-methylphenyl)-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one Traditional Name: 2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(p-tolyl)propan-1-one Formula: C15H17N3OS2 MolecularWeight: 319.44498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)SC2=NN=C(S2)NCC=C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)SC2=NN=C(S2)NCC=C

InChI

InChI=1S/C15H17N3OS2/c1-4-9-16-14-17-18-15(21-14)20-11(3)13(19)12-7-5-10(2)6-8-12/h4-8,11H,1,9H2,2-3H3,(H,16,17)