2-[2-(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1-chloranyl-ethylidene]-N-phenyl-3H-1,3,4-thiadiazole-5-carboxamide

Systemtic Name: 2-[2-(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1-chloranyl-ethylidene]-N-phenyl-3H-1,3,4-thiadiazole-5-carboxamide Openeye Name: 2-[2-(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-1-chloro-ethylidene]-N-phenyl-3H-1,3,4-thiadiazole-5-carboxamide CAS Name: 2-[2-(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-1-chloroethylidene]-N-phenyl-3H-1,3,4-thiadiazole-5-carboxamide IUPAC Name: 2-[2-(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-1-chloroethylidene]-N-phenyl-3H-1,3,4-thiadiazole-5-carboxamide Traditional Name: 2-[2-(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)-1-chloro-ethylidene]-N-phenyl-3H-1,3,4-thiadiazole-5-carboxamide Formula: C18H13BrClN3O3S MolecularWeight: 466.73612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C2NN=C(S2)C(=O)NC3=CC=CC=C3)Cl)C=C(C1=O)Br

Isomeric SMILES

COC1=CC(=CC(=C2NN=C(S2)C(=O)NC3=CC=CC=C3)Cl)C=C(C1=O)Br

InChI

InChI=1S/C18H13BrClN3O3S/c1-26-14-9-10(7-12(19)15(14)24)8-13(20)17-22-23-18(27-17)16(25)21-11-5-3-2-4-6-11/h2-9,22H,1H3,(H,21,25)