4-(2,1,3-benzothiadiazol-5-ylmethylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide

Systemtic Name: 4-(2,1,3-benzothiadiazol-5-ylmethylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide Openeye Name: 4-(2,1,3-benzothiadiazol-5-ylmethylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide CAS Name: 4-(2,1,3-benzothiadiazol-5-ylmethylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)-1-cyclohexenecarboxamide IUPAC Name: 4-(2,1,3-benzothiadiazol-5-ylmethylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide Traditional Name: N-(6-methoxy-1,5-naphthyridin-4-yl)-4-(piazthiol-5-ylmethylamino)cyclohexene-1-carboxamide Formula: C23H22N6O2S MolecularWeight: 446.52478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C=CN=C2C=C1)NC(=O)C3=CCC(CC3)NCC4=CC5=NSN=C5C=C4

Isomeric SMILES

COC1=NC2=C(C=CN=C2C=C1)NC(=O)C3=CCC(CC3)NCC4=CC5=NSN=C5C=C4

InChI

InChI=1S/C23H22N6O2S/c1-31-21-9-8-18-22(27-21)19(10-11-24-18)26-23(30)15-3-5-16(6-4-15)25-13-14-2-7-17-20(12-14)29-32-28-17/h2-3,7-12,16,25H,4-6,13H2,1H3,(H,24,26,30)