N-(4-azanylcyclohexyl)-N-[[3-(4-morpholin-4-yl-3-nitro-phenyl)phenyl]methyl]thiophene-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-N-[[3-(4-morpholin-4-yl-3-nitro-phenyl)phenyl]methyl]thiophene-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-N-[[3-(4-morpholino-3-nitro-phenyl)phenyl]methyl]thiophene-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-N-[[3-[4-(4-morpholinyl)-3-nitrophenyl]phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-N-[[3-(4-morpholin-4-yl-3-nitrophenyl)phenyl]methyl]thiophene-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-N-[3-(4-morpholino-3-nitro-phenyl)benzyl]thiophene-2-carboxamide Formula: C28H32N4O4S MolecularWeight: 520.64308

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N(CC2=CC=CC(=C2)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])C(=O)C5=CC=CS5

Isomeric SMILES

C1CC(CCC1N)N(CC2=CC=CC(=C2)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])C(=O)C5=CC=CS5

InChI

InChI=1S/C28H32N4O4S/c29-23-7-9-24(10-8-23)31(28(33)27-5-2-16-37-27)19-20-3-1-4-21(17-20)22-6-11-25(26(18-22)32(34)35)30-12-14-36-15-13-30/h1-6,11,16-18,23-24H,7-10,12-15,19,29H2