2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanyl-N-(1H-indol-6-yl)ethanamide

Systemtic Name: 2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanyl-N-(1H-indol-6-yl)ethanamide Openeye Name: 2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylene)-5-oxo-1-phenyl-imidazol-2-yl]sulfanyl-N-(1H-indol-6-yl)acetamide CAS Name: 2-[[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-oxo-1-phenyl-2-imidazolyl]thio]-N-(1H-indol-6-yl)acetamide IUPAC Name: 2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-oxo-1-phenylimidazol-2-yl]sulfanyl-N-(1H-indol-6-yl)acetamide Traditional Name: N-(1H-indol-6-yl)-2-[[(4Z)-5-keto-1-phenyl-4-piperonylidene-2-imidazolin-2-yl]thio]acetamide Formula: C27H20N4O4S MolecularWeight: 496.5371

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N(C(=N3)SCC(=O)NC4=CC5=C(C=C4)C=CN5)C6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C\3/C(=O)N(C(=N3)SCC(=O)NC4=CC5=C(C=C4)C=CN5)C6=CC=CC=C6

InChI

InChI=1S/C27H20N4O4S/c32-25(29-19-8-7-18-10-11-28-21(18)14-19)15-36-27-30-22(26(33)31(27)20-4-2-1-3-5-20)12-17-6-9-23-24(13-17)35-16-34-23/h1-14,28H,15-16H2,(H,29,32)/b22-12-