2-[6-azanyl-3,5-dicyano-4-(3,4-dimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[6-azanyl-3,5-dicyano-4-(3,4-dimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(3,4-dimethoxyphenyl)-2-pyridyl]sulfanyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[[6-amino-3,5-dicyano-4-(3,4-dimethoxyphenyl)-2-pyridinyl]thio]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[6-amino-3,5-dicyano-4-(3,4-dimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(3,4-dimethoxyphenyl)-2-pyridyl]thio]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide Formula: C26H22N6O4S2 MolecularWeight: 546.62068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=C(C(=C(C(=N3)N)C#N)C4=CC(=C(C=C4)OC)OC)C#N

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=C(C(=C(C(=N3)N)C#N)C4=CC(=C(C=C4)OC)OC)C#N

InChI

InChI=1S/C26H22N6O4S2/c1-4-36-15-6-7-18-21(10-15)38-26(30-18)31-22(33)13-37-25-17(12-28)23(16(11-27)24(29)32-25)14-5-8-19(34-2)20(9-14)35-3/h5-10H,4,13H2,1-3H3,(H2,29,32)(H,30,31,33)