[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-(8-nitro-5-isoquinolyl)piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-(8-nitro-5-isoquinolinyl)-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-(8-nitro-5-isoquinolyl)piperazino]-(2-thienyl)methanone Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])C(=O)C4=CC=CS4

InChI

InChI=1S/C18H16N4O3S/c23-18(17-2-1-11-26-17)21-9-7-20(8-10-21)15-3-4-16(22(24)25)14-12-19-6-5-13(14)15/h1-6,11-12H,7-10H2