2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(phenylmethyl)propanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(phenylmethyl)propanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-benzyl-propanamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-(phenylmethyl)propanamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-benzylpropanamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-benzyl-propionamide Formula: C15H15N5OS MolecularWeight: 313.3775

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)SC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C15H15N5OS/c1-10(14(21)18-8-11-5-3-2-4-6-11)22-15-19-9-12(7-16)13(17)20-15/h2-6,9-10H,8H2,1H3,(H,18,21)(H2,17,19,20)