4-[(E)-[(5E)-5-[(4-carbamimidoylphenyl)methylidene]-4-oxidanylidene-thian-3-ylidene]methyl]benzenecarboximidamide

Systemtic Name: 4-[(E)-[(5E)-5-[(4-carbamimidoylphenyl)methylidene]-4-oxidanylidene-thian-3-ylidene]methyl]benzenecarboximidamide Openeye Name: 4-[(E)-[(5E)-5-[(4-carbamimidoylphenyl)methylene]-4-oxo-tetrahydrothiopyran-3-ylidene]methyl]benzamidine CAS Name: 4-[(E)-[(5E)-5-[(4-carbamimidoylphenyl)methylidene]-4-oxo-3-thianylidene]methyl]benzenecarboximidamide IUPAC Name: 4-[(E)-[(5E)-5-[(4-carbamimidoylphenyl)methylidene]-4-oxothian-3-ylidene]methyl]benzenecarboximidamide Traditional Name: 4-[(E)-[(5E)-5-(4-amidinobenzylidene)-4-keto-tetrahydrothiopyran-3-ylidene]methyl]benzamidine Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC=C(C=C2)C(=N)N)C(=O)C(=CC3=CC=C(C=C3)C(=N)N)CS1

Isomeric SMILES

C\1SC/C(=C/C2=CC=C(C=C2)C(=N)N)/C(=O)/C1=C\C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H20N4OS/c22-20(23)15-5-1-13(2-6-15)9-17-11-27-12-18(19(17)26)10-14-3-7-16(8-4-14)21(24)25/h1-10H,11-12H2,(H3,22,23)(H3,24,25)/b17-9-,18-10-