2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(4-piperidin-1-ylphenyl)ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(4-piperidin-1-ylphenyl)ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-[4-(1-piperidyl)phenyl]acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-[4-(1-piperidinyl)phenyl]acetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-(4-piperidin-1-ylphenyl)acetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-(4-piperidinophenyl)acetamide Formula: C18H20N6OS MolecularWeight: 368.456

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=NC=C(C(=N3)N)C#N

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=NC=C(C(=N3)N)C#N

InChI

InChI=1S/C18H20N6OS/c19-10-13-11-21-18(23-17(13)20)26-12-16(25)22-14-4-6-15(7-5-14)24-8-2-1-3-9-24/h4-7,11H,1-3,8-9,12H2,(H,22,25)(H2,20,21,23)