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

Systemtic Name: 2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanyl-N-phenyl-N-propan-2-yl-ethanamide Openeye Name: 2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylene)-5-oxo-1-phenyl-imidazol-2-yl]sulfanyl-N-isopropyl-N-phenyl-acetamide CAS Name: 2-[[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-oxo-1-phenyl-2-imidazolyl]thio]-N-phenyl-N-propan-2-ylacetamide IUPAC Name: 2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-oxo-1-phenylimidazol-2-yl]sulfanyl-N-phenyl-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[[(4Z)-5-keto-1-phenyl-4-piperonylidene-2-imidazolin-2-yl]thio]-N-phenyl-acetamide Formula: C28H25N3O4S MolecularWeight: 499.5808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)CSC2=NC(=CC3=CC4=C(C=C3)OCO4)C(=O)N2C5=CC=CC=C5

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)CSC2=N/C(=C\C3=CC4=C(C=C3)OCO4)/C(=O)N2C5=CC=CC=C5

InChI

InChI=1S/C28H25N3O4S/c1-19(2)30(21-9-5-3-6-10-21)26(32)17-36-28-29-23(27(33)31(28)22-11-7-4-8-12-22)15-20-13-14-24-25(16-20)35-18-34-24/h3-16,19H,17-18H2,1-2H3/b23-15-