N-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(7-phenylpteridin-4-yl)piperidine-4-carboxamide

Systemtic Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(7-phenylpteridin-4-yl)piperidine-4-carboxamide Openeye Name: N-(4,5-dimethylthiazol-2-yl)-1-(7-phenylpteridin-4-yl)piperidine-4-carboxamide CAS Name: N-(4,5-dimethyl-2-thiazolyl)-1-(7-phenyl-4-pteridinyl)-4-piperidinecarboxamide IUPAC Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(7-phenylpteridin-4-yl)piperidine-4-carboxamide Traditional Name: N-(4,5-dimethylthiazol-2-yl)-1-(7-phenylpteridin-4-yl)isonipecotamide Formula: C23H23N7OS MolecularWeight: 445.54002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2CCN(CC2)C3=NC=NC4=NC(=CN=C43)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2CCN(CC2)C3=NC=NC4=NC(=CN=C43)C5=CC=CC=C5)C

InChI

InChI=1S/C23H23N7OS/c1-14-15(2)32-23(27-14)29-22(31)17-8-10-30(11-9-17)21-19-20(25-13-26-21)28-18(12-24-19)16-6-4-3-5-7-16/h3-7,12-13,17H,8-11H2,1-2H3,(H,27,29,31)