2-(4-nitrophenyl)sulfanyl-N-quinolin-7-yl-benzamide

Systemtic Name: 2-(4-nitrophenyl)sulfanyl-N-quinolin-7-yl-benzamide Openeye Name: 2-(4-nitrophenyl)sulfanyl-N-(7-quinolyl)benzamide CAS Name: 2-[(4-nitrophenyl)thio]-N-(7-quinolinyl)benzamide IUPAC Name: 2-(4-nitrophenyl)sulfanyl-N-quinolin-7-ylbenzamide Traditional Name: 2-[(4-nitrophenyl)thio]-N-(7-quinolyl)benzamide Formula: C22H15N3O3S MolecularWeight: 401.4378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC3=C(C=CC=N3)C=C2)SC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC3=C(C=CC=N3)C=C2)SC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H15N3O3S/c26-22(24-16-8-7-15-4-3-13-23-20(15)14-16)19-5-1-2-6-21(19)29-18-11-9-17(10-12-18)25(27)28/h1-14H,(H,24,26)