N-[[3-(3H-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]carbamothioyl]-5-(4-bromophenyl)furan-2-carboxamide

Systemtic Name: N-[[3-(3H-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]carbamothioyl]-5-(4-bromophenyl)furan-2-carboxamide Openeye Name: N-[[3-(3H-1,3-benzothiazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]carbamothioyl]-5-(4-bromophenyl)furan-2-carboxamide CAS Name: N-[[[3-(3H-1,3-benzothiazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]amino]-sulfanylidenemethyl]-5-(4-bromophenyl)-2-furancarboxamide IUPAC Name: N-[[3-(3H-1,3-benzothiazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-5-(4-bromophenyl)furan-2-carboxamide Traditional Name: N-[[3-(3H-1,3-benzothiazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]thiocarbamoyl]-5-(4-bromophenyl)-2-furamide Formula: C25H16BrN3O3S2 MolecularWeight: 550.44684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C3C=C(C=CC3=O)NC(=S)NC(=O)C4=CC=C(O4)C5=CC=C(C=C5)Br)S2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C3C=C(C=CC3=O)NC(=S)NC(=O)C4=CC=C(O4)C5=CC=C(C=C5)Br)S2

InChI

InChI=1S/C25H16BrN3O3S2/c26-15-7-5-14(6-8-15)20-11-12-21(32-20)23(31)29-25(33)27-16-9-10-19(30)17(13-16)24-28-18-3-1-2-4-22(18)34-24/h1-13,28H,(H2,27,29,31,33)