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

Systemtic Name: 4-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-thiophen-2-yl-butan-1-one Openeye Name: 4-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(2-thienyl)butan-1-one CAS Name: 4-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]thio]-1-thiophen-2-yl-1-butanone IUPAC Name: 4-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-thiophen-2-ylbutan-1-one Traditional Name: 4-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(2-thienyl)butan-1-one Formula: C13H15N3OS3 MolecularWeight: 325.4727

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NN=C(S1)SCCCC(=O)C2=CC=CS2

Isomeric SMILES

C=CCNC1=NN=C(S1)SCCCC(=O)C2=CC=CS2

InChI

InChI=1S/C13H15N3OS3/c1-2-7-14-12-15-16-13(20-12)19-9-3-5-10(17)11-6-4-8-18-11/h2,4,6,8H,1,3,5,7,9H2,(H,14,15)