5-morpholin-4-yl-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-4-phenyl-thiophene-2-carboxamide

Systemtic Name: 5-morpholin-4-yl-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-4-phenyl-thiophene-2-carboxamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-5-morpholino-4-phenyl-thiophene-2-carboxamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-5-(4-morpholinyl)-4-phenyl-2-thiophenecarboxamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-5-morpholino-4-phenyl-thiophene-2-carboxamide Formula: C22H21N3O5S MolecularWeight: 439.48424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(S2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=C(C=C(S2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O5S/c26-19-7-6-17(25(28)29)12-16(19)14-23-21(27)20-13-18(15-4-2-1-3-5-15)22(31-20)24-8-10-30-11-9-24/h1-7,12-13,26H,8-11,14H2,(H,23,27)