4-azanyl-2-(3-cyanophenyl)-N-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-azanyl-2-(3-cyanophenyl)-N-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-amino-2-(3-cyanophenyl)-N-(3-pyridylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-amino-2-(3-cyanophenyl)-N-(3-pyridinylmethyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-amino-2-(3-cyanophenyl)-N-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-amino-2-(3-cyanophenyl)-N-(3-pyridylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H14N6OS MolecularWeight: 386.42976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=NC(=C3C=C(SC3=N2)C(=O)NCC4=CN=CC=C4)N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C2=NC(=C3C=C(SC3=N2)C(=O)NCC4=CN=CC=C4)N)C#N

InChI

InChI=1S/C20H14N6OS/c21-9-12-3-1-5-14(7-12)18-25-17(22)15-8-16(28-20(15)26-18)19(27)24-11-13-4-2-6-23-10-13/h1-8,10H,11H2,(H,24,27)(H2,22,25,26)