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

Systemtic Name: 5-azanylidene-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-methoxy-4-prop-2-enoxy-phenyl)methylidene]thiolan-3-one Openeye Name: 2-[(4-allyloxy-3-methoxy-phenyl)methylene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-tetrahydrothiophen-3-one CAS Name: 4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-2-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-3-thiolanone IUPAC Name: 4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-2-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]thiolan-3-one Traditional Name: 2-(4-allyloxy-3-methoxy-benzylidene)-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-tetrahydrothiophen-3-one Formula: C19H19N3O3S2 MolecularWeight: 401.50246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O3S2/c1-4-8-25-12-7-6-11(9-13(12)24-3)10-14-17(23)16(18(20)26-14)19-22-21-15(5-2)27-19/h4,6-7,9-10,16,20H,1,5,8H2,2-3H3