(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-N-[(3Z)-3-[4-[3,4-bis(oxidanylidene)cyclohexa-1,5-dien-1-yl]-3H-1,3-thiazol-2-ylidene]-2-[bis(oxidanyl)methylidene]-7-methanethioyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-2-methoxyimino-ethanamide

Systemtic Name: (2E)-2-(2-azanyl-1,3-thiazol-4-yl)-N-[(3Z)-3-[4-[3,4-bis(oxidanylidene)cyclohexa-1,5-dien-1-yl]-3H-1,3-thiazol-2-ylidene]-2-[bis(oxidanyl)methylidene]-7-methanethioyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-2-methoxyimino-ethanamide Openeye Name: (2E)-2-(2-aminothiazol-4-yl)-N-[(3Z)-2-(dihydroxymethylene)-3-[4-(3,4-dioxocyclohexa-1,5-dien-1-yl)-3H-thiazol-2-ylidene]-7-methanethioyl-8-oxo-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-2-methoxyimino-acetamide CAS Name: (2E)-2-(2-amino-4-thiazolyl)-N-[(3Z)-2-(dihydroxymethylidene)-3-[4-(3,4-dioxo-1-cyclohexa-1,5-dienyl)-3H-thiazol-2-ylidene]-7-methanethioyl-8-oxo-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-2-methoxyiminoacetamide IUPAC Name: (2E)-2-(2-amino-1,3-thiazol-4-yl)-N-[(3Z)-2-(dihydroxymethylidene)-3-[4-(3,4-dioxocyclohexa-1,5-dien-1-yl)-3H-1,3-thiazol-2-ylidene]-7-methanethioyl-8-oxo-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-2-methoxyiminoacetamide Traditional Name: (2E)-2-(2-aminothiazol-4-yl)-N-[(3Z)-2-(dihydroxymethylene)-3-[4-(3,4-diketocyclohexa-1,5-dien-1-yl)-4-thiazolin-2-ylidene]-8-keto-7-thioformyl-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-2-methyloximino-acetamide Formula: C23H18N6O7S4 MolecularWeight: 618.68502

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(C1=CSC(=N1)N)C(=O)NC2(C3N(C2=O)C(=C(O)O)C(=C4NC(=CS4)C5=CC(=O)C(=O)C=C5)CS3)C=S

Isomeric SMILES

CO/N=C(\C1=CSC(=N1)N)/C(=O)NC2(C3N(C2=O)C(=C(O)O)/C(=C/4\NC(=CS4)C5=CC(=O)C(=O)C=C5)/CS3)C=S

InChI

InChI=1S/C23H18N6O7S4/c1-36-28-15(12-7-40-22(24)26-12)17(32)27-23(8-37)20(35)29-16(19(33)34)10(5-39-21(23)29)18-25-11(6-38-18)9-2-3-13(30)14(31)4-9/h2-4,6-8,21,25,33-34H,5H2,1H3,(H2,24,26)(H,27,32)/b18-10+,28-15+