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

Systemtic Name: 5-azanylidene-2-[(3-bromanyl-4-prop-2-enoxy-phenyl)methylidene]-4-(1,3-thiazol-2-yl)thiolan-3-one Openeye Name: 2-[(4-allyloxy-3-bromo-phenyl)methylene]-5-imino-4-thiazol-2-yl-tetrahydrothiophen-3-one CAS Name: 2-[(3-bromo-4-prop-2-enoxyphenyl)methylidene]-5-imino-4-(2-thiazolyl)-3-thiolanone IUPAC Name: 2-[(3-bromo-4-prop-2-enoxyphenyl)methylidene]-5-imino-4-(1,3-thiazol-2-yl)thiolan-3-one Traditional Name: 2-(4-allyloxy-3-bromo-benzylidene)-5-imino-4-thiazol-2-yl-tetrahydrothiophen-3-one Formula: C17H13BrN2O2S2 MolecularWeight: 421.33132

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=C(C=C(C=C1)C=C2C(=O)C(C(=N)S2)C3=NC=CS3)Br

Isomeric SMILES

C=CCOC1=C(C=C(C=C1)C=C2C(=O)C(C(=N)S2)C3=NC=CS3)Br

InChI

InChI=1S/C17H13BrN2O2S2/c1-2-6-22-12-4-3-10(8-11(12)18)9-13-15(21)14(16(19)24-13)17-20-5-7-23-17/h2-5,7-9,14,19H,1,6H2