N-(1-methyl-4-oxidanylidene-3-thiophen-2-yl-quinolin-2-yl)-4-nitro-benzamide

Systemtic Name: N-(1-methyl-4-oxidanylidene-3-thiophen-2-yl-quinolin-2-yl)-4-nitro-benzamide Openeye Name: N-[1-methyl-4-oxo-3-(2-thienyl)-2-quinolyl]-4-nitro-benzamide CAS Name: N-(1-methyl-4-oxo-3-thiophen-2-yl-2-quinolinyl)-4-nitrobenzamide IUPAC Name: N-(1-methyl-4-oxo-3-thiophen-2-ylquinolin-2-yl)-4-nitrobenzamide Traditional Name: N-[4-keto-1-methyl-3-(2-thienyl)-2-quinolyl]-4-nitro-benzamide Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C(=C1NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C(=C1NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C21H15N3O4S/c1-23-16-6-3-2-5-15(16)19(25)18(17-7-4-12-29-17)20(23)22-21(26)13-8-10-14(11-9-13)24(27)28/h2-12H,1H3,(H,22,26)