2-[(5-nitrofuran-2-yl)methyl]-7-oxidanyl-N-phenyl-1-thiophen-2-yl-1H-isoquinoline-4-carboxamide

Systemtic Name: 2-[(5-nitrofuran-2-yl)methyl]-7-oxidanyl-N-phenyl-1-thiophen-2-yl-1H-isoquinoline-4-carboxamide Openeye Name: 7-hydroxy-2-[(5-nitro-2-furyl)methyl]-N-phenyl-1-(2-thienyl)-1H-isoquinoline-4-carboxamide CAS Name: 7-hydroxy-2-[(5-nitro-2-furanyl)methyl]-N-phenyl-1-thiophen-2-yl-1H-isoquinoline-4-carboxamide IUPAC Name: 7-hydroxy-2-[(5-nitrofuran-2-yl)methyl]-N-phenyl-1-thiophen-2-yl-1H-isoquinoline-4-carboxamide Traditional Name: 7-hydroxy-2-[(5-nitro-2-furyl)methyl]-N-phenyl-1-(2-thienyl)-1H-isoquinoline-4-carboxamide Formula: C25H19N3O5S MolecularWeight: 473.50046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CN(C(C3=C2C=CC(=C3)O)C4=CC=CS4)CC5=CC=C(O5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CN(C(C3=C2C=CC(=C3)O)C4=CC=CS4)CC5=CC=C(O5)[N+](=O)[O-]

InChI

InChI=1S/C25H19N3O5S/c29-17-8-10-19-20(13-17)24(22-7-4-12-34-22)27(14-18-9-11-23(33-18)28(31)32)15-21(19)25(30)26-16-5-2-1-3-6-16/h1-13,15,24,29H,14H2,(H,26,30)