5-azanylidene-2-[(3-chloranyl-5-ethoxy-4-oxidanyl-phenyl)methylidene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)thiolan-3-one

Systemtic Name: 5-azanylidene-2-[(3-chloranyl-5-ethoxy-4-oxidanyl-phenyl)methylidene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)thiolan-3-one Openeye Name: 2-[(3-chloro-5-ethoxy-4-hydroxy-phenyl)methylene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-tetrahydrothiophen-3-one CAS Name: 2-[(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-3-thiolanone IUPAC Name: 2-[(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-iminothiolan-3-one Traditional Name: 2-(3-chloro-5-ethoxy-4-hydroxy-benzylidene)-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-tetrahydrothiophen-3-one Formula: C17H16ClN3O3S2 MolecularWeight: 409.91024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN3O3S2/c1-3-12-20-21-17(26-12)13-15(23)11(25-16(13)19)7-8-5-9(18)14(22)10(6-8)24-4-2/h5-7,13,19,22H,3-4H2,1-2H3