N-[3-(3-morpholin-4-ylpropylamino)-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-(3-morpholin-4-ylpropylamino)-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]thiophene-2-carboxamide Openeye Name: N-[1-(3-morpholinopropylcarbamoyl)-2-(3-nitrophenyl)vinyl]thiophene-2-carboxamide CAS Name: N-[3-[3-(4-morpholinyl)propylamino]-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-(3-morpholin-4-ylpropylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide Traditional Name: N-[1-(3-morpholinopropylcarbamoyl)-2-(3-nitrophenyl)vinyl]thiophene-2-carboxamide Formula: C21H24N4O5S MolecularWeight: 444.50406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)C(=CC2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC=CS3

Isomeric SMILES

C1COCCN1CCCNC(=O)C(=CC2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H24N4O5S/c26-20(22-7-3-8-24-9-11-30-12-10-24)18(23-21(27)19-6-2-13-31-19)15-16-4-1-5-17(14-16)25(28)29/h1-2,4-6,13-15H,3,7-12H2,(H,22,26)(H,23,27)