N-(azanylidenecarbamothioyl)-3-(6-methoxy-2-methyl-quinolin-4-yl)pyridine-4-carboxamide

Systemtic Name: N-(azanylidenecarbamothioyl)-3-(6-methoxy-2-methyl-quinolin-4-yl)pyridine-4-carboxamide Openeye Name: N-(iminocarbamothioyl)-3-(6-methoxy-2-methyl-4-quinolyl)pyridine-4-carboxamide CAS Name: N-[diazenyl(sulfanylidene)methyl]-3-(6-methoxy-2-methyl-4-quinolinyl)-4-pyridinecarboxamide IUPAC Name: N-(iminocarbamothioyl)-3-(6-methoxy-2-methylquinolin-4-yl)pyridine-4-carboxamide Traditional Name: N-(iminothiocarbamoyl)-3-(6-methoxy-2-methyl-4-quinolyl)isonicotinamide Formula: C18H15N5O2S MolecularWeight: 365.409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)OC)C(=C1)C3=C(C=CN=C3)C(=O)NC(=S)N=N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)OC)C(=C1)C3=C(C=CN=C3)C(=O)NC(=S)N=N

InChI

InChI=1S/C18H15N5O2S/c1-10-7-13(14-8-11(25-2)3-4-16(14)21-10)15-9-20-6-5-12(15)17(24)22-18(26)23-19/h3-9,19H,1-2H3,(H,22,24,26)