3-[6-azanyl-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-pyridin-4-yl-propanamide

Systemtic Name: 3-[6-azanyl-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-pyridin-4-yl-propanamide Openeye Name: 3-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridyl]sulfanyl]-N-(4-pyridyl)propanamide CAS Name: 3-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridinyl]thio]-N-pyridin-4-ylpropanamide IUPAC Name: 3-[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-pyridin-4-ylpropanamide Traditional Name: 3-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridyl]thio]-N-(4-pyridyl)propionamide Formula: C24H22N6O4S MolecularWeight: 490.53428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=C2C#N)SCCC(=O)NC3=CC=NC=C3)N)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=C2C#N)SCCC(=O)NC3=CC=NC=C3)N)C#N

InChI

InChI=1S/C24H22N6O4S/c1-32-18-10-14(11-19(33-2)22(18)34-3)21-16(12-25)23(27)30-24(17(21)13-26)35-9-6-20(31)29-15-4-7-28-8-5-15/h4-5,7-8,10-11H,6,9H2,1-3H3,(H2,27,30)(H,28,29,31)