9-(1-methylpyrazol-4-yl)-6-(thiophen-3-ylmethylamino)-2H-benzo[c][1,6]naphthyridin-1-one

Systemtic Name: 9-(1-methylpyrazol-4-yl)-6-(thiophen-3-ylmethylamino)-2H-benzo[c][1,6]naphthyridin-1-one Openeye Name: 9-(1-methylpyrazol-4-yl)-6-(3-thienylmethylamino)-2H-benzo[c][1,6]naphthyridin-1-one CAS Name: 9-(1-methyl-4-pyrazolyl)-6-(3-thiophenylmethylamino)-2H-benzo[c][1,6]naphthyridin-1-one IUPAC Name: 9-(1-methylpyrazol-4-yl)-6-(thiophen-3-ylmethylamino)-2H-benzo[c][1,6]naphthyridin-1-one Traditional Name: 9-(1-methylpyrazol-4-yl)-6-(3-thenylamino)-2H-benzo[c][1,6]naphthyridin-1-one Formula: C21H17N5OS MolecularWeight: 387.45758

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=CC3=C(C=C2)C(=NC4=C3C(=O)NC=C4)NCC5=CSC=C5

Isomeric SMILES

CN1C=C(C=N1)C2=CC3=C(C=C2)C(=NC4=C3C(=O)NC=C4)NCC5=CSC=C5

InChI

InChI=1S/C21H17N5OS/c1-26-11-15(10-24-26)14-2-3-16-17(8-14)19-18(4-6-22-21(19)27)25-20(16)23-9-13-5-7-28-12-13/h2-8,10-12H,9H2,1H3,(H,22,27)(H,23,25)