5-azanylidene-2-[(3-bromanyl-4-prop-2-enoxy-phenyl)methylidene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)thiolan-3-one

Systemtic Name: 5-azanylidene-2-[(3-bromanyl-4-prop-2-enoxy-phenyl)methylidene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)thiolan-3-one Openeye Name: 2-[(4-allyloxy-3-bromo-phenyl)methylene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-tetrahydrothiophen-3-one CAS Name: 2-[(3-bromo-4-prop-2-enoxyphenyl)methylidene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-3-thiolanone IUPAC Name: 2-[(3-bromo-4-prop-2-enoxyphenyl)methylidene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-iminothiolan-3-one Traditional Name: 2-(4-allyloxy-3-bromo-benzylidene)-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-tetrahydrothiophen-3-one Formula: C18H16BrN3O2S2 MolecularWeight: 450.37254

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)C2C(=O)C(=CC3=CC(=C(C=C3)OCC=C)Br)SC2=N

Isomeric SMILES

CCC1=NN=C(S1)C2C(=O)C(=CC3=CC(=C(C=C3)OCC=C)Br)SC2=N

InChI

InChI=1S/C18H16BrN3O2S2/c1-3-7-24-12-6-5-10(8-11(12)19)9-13-16(23)15(17(20)25-13)18-22-21-14(4-2)26-18/h3,5-6,8-9,15,20H,1,4,7H2,2H3