1-[4-ethoxy-3-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenyl]ethanone

Systemtic Name: 1-[4-ethoxy-3-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenyl]ethanone Openeye Name: 1-[3-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-4-ethoxy-phenyl]ethanone CAS Name: 1-[4-ethoxy-3-[[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]phenyl]ethanone IUPAC Name: 1-[4-ethoxy-3-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenyl]ethanone Traditional Name: 1-[3-[[[5-(allylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-4-ethoxy-phenyl]ethanone Formula: C16H19N3O2S2 MolecularWeight: 349.47096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NN=C(S2)NCC=C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NN=C(S2)NCC=C

InChI

InChI=1S/C16H19N3O2S2/c1-4-8-17-15-18-19-16(23-15)22-10-13-9-12(11(3)20)6-7-14(13)21-5-2/h4,6-7,9H,1,5,8,10H2,2-3H3,(H,17,18)