N-(4-phenyl-1,3-thiazol-2-yl)-1-pteridin-4-yl-piperidine-4-carboxamide

Systemtic Name: N-(4-phenyl-1,3-thiazol-2-yl)-1-pteridin-4-yl-piperidine-4-carboxamide Openeye Name: N-(4-phenylthiazol-2-yl)-1-pteridin-4-yl-piperidine-4-carboxamide CAS Name: N-(4-phenyl-2-thiazolyl)-1-(4-pteridinyl)-4-piperidinecarboxamide IUPAC Name: N-(4-phenyl-1,3-thiazol-2-yl)-1-pteridin-4-ylpiperidine-4-carboxamide Traditional Name: N-(4-phenylthiazol-2-yl)-1-pteridin-4-yl-isonipecotamide Formula: C21H19N7OS MolecularWeight: 417.48686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC(=CS2)C3=CC=CC=C3)C4=NC=NC5=NC=CN=C54

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC(=CS2)C3=CC=CC=C3)C4=NC=NC5=NC=CN=C54

InChI

InChI=1S/C21H19N7OS/c29-20(27-21-26-16(12-30-21)14-4-2-1-3-5-14)15-6-10-28(11-7-15)19-17-18(24-13-25-19)23-9-8-22-17/h1-5,8-9,12-13,15H,6-7,10-11H2,(H,26,27,29)