2-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 2-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)sulfanyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 2-[(6-amino-3,5-dicyano-4-phenyl-2-pyridinyl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 2-(6-amino-3,5-dicyano-4-phenylpyridin-2-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 2-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)propionamide Formula: C24H18N6O2S2 MolecularWeight: 486.56872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=C(C(=C(C(=N3)N)C#N)C4=CC=CC=C4)C#N

Isomeric SMILES

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=C(C(=C(C(=N3)N)C#N)C4=CC=CC=C4)C#N

InChI

InChI=1S/C24H18N6O2S2/c1-13(22(31)30-24-28-18-9-8-15(32-2)10-19(18)34-24)33-23-17(12-26)20(14-6-4-3-5-7-14)16(11-25)21(27)29-23/h3-10,13H,1-2H3,(H2,27,29)(H,28,30,31)