[4-(4-nitrophenyl)piperazin-1-yl]-(2-thiophen-3-ylquinolin-4-yl)methanone

Systemtic Name: [4-(4-nitrophenyl)piperazin-1-yl]-(2-thiophen-3-ylquinolin-4-yl)methanone Openeye Name: [4-(4-nitrophenyl)piperazin-1-yl]-[2-(3-thienyl)-4-quinolyl]methanone CAS Name: [4-(4-nitrophenyl)-1-piperazinyl]-[2-(3-thiophenyl)-4-quinolinyl]methanone IUPAC Name: [4-(4-nitrophenyl)piperazin-1-yl]-(2-thiophen-3-ylquinolin-4-yl)methanone Traditional Name: [4-(4-nitrophenyl)piperazino]-[2-(3-thienyl)-4-quinolyl]methanone Formula: C24H20N4O3S MolecularWeight: 444.5056

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=NC4=CC=CC=C43)C5=CSC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=NC4=CC=CC=C43)C5=CSC=C5

InChI

InChI=1S/C24H20N4O3S/c29-24(27-12-10-26(11-13-27)18-5-7-19(8-6-18)28(30)31)21-15-23(17-9-14-32-16-17)25-22-4-2-1-3-20(21)22/h1-9,14-16H,10-13H2