3,6-bis(azanyl)-5-cyano-N-cycloheptyl-4-thiophen-2-yl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3,6-bis(azanyl)-5-cyano-N-cycloheptyl-4-thiophen-2-yl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3,6-diamino-5-cyano-N-cycloheptyl-4-(2-thienyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3,6-diamino-5-cyano-N-cycloheptyl-4-thiophen-2-yl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3,6-diamino-5-cyano-N-cycloheptyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3,6-diamino-5-cyano-N-cycloheptyl-4-(2-thienyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C20H21N5OS2 MolecularWeight: 411.54364

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=C(C3=C(S2)N=C(C(=C3C4=CC=CS4)C#N)N)N

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=C(C3=C(S2)N=C(C(=C3C4=CC=CS4)C#N)N)N

InChI

InChI=1S/C20H21N5OS2/c21-10-12-14(13-8-5-9-27-13)15-16(22)17(28-20(15)25-18(12)23)19(26)24-11-6-3-1-2-4-7-11/h5,8-9,11H,1-4,6-7,22H2,(H2,23,25)(H,24,26)