4-(1,3-benzothiazol-5-ylmethylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexane-1-carboxamide; ethanedioic acid

Systemtic Name: 4-(1,3-benzothiazol-5-ylmethylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexane-1-carboxamide; ethanedioic acid Openeye Name: 4-(1,3-benzothiazol-5-ylmethylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexanecarboxamide; oxalic acid CAS Name: 4-(1,3-benzothiazol-5-ylmethylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)-1-cyclohexanecarboxamide; oxalic acid IUPAC Name: 4-(1,3-benzothiazol-5-ylmethylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexane-1-carboxamide; oxalic acid Traditional Name: 4-(1,3-benzothiazol-5-ylmethylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexanecarboxamide; oxalic acid Formula: C26H27N5O6S MolecularWeight: 537.58748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C=CN=C2C=C1)NC(=O)C3CCC(CC3)NCC4=CC5=C(C=C4)SC=N5.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=NC2=C(C=CN=C2C=C1)NC(=O)C3CCC(CC3)NCC4=CC5=C(C=C4)SC=N5.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H25N5O2S.C2H2O4/c1-31-22-9-7-18-23(29-22)19(10-11-25-18)28-24(30)16-3-5-17(6-4-16)26-13-15-2-8-21-20(12-15)27-14-32-21;3-1(4)2(5)6/h2,7-12,14,16-17,26H,3-6,13H2,1H3,(H,25,28,30);(H,3,4)(H,5,6)