N-(1-phenylbutyl)-2-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-(1-phenylbutyl)-2-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(1-phenylbutyl)-2-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(1-phenylbutyl)-2-(2-pyrimidinylthio)propanamide IUPAC Name: N-(1-phenylbutyl)-2-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(1-phenylbutyl)-2-(2-pyrimidylthio)propionamide Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C(C)SC2=NC=CC=N2

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)C(C)SC2=NC=CC=N2

InChI

InChI=1S/C17H21N3OS/c1-3-8-15(14-9-5-4-6-10-14)20-16(21)13(2)22-17-18-11-7-12-19-17/h4-7,9-13,15H,3,8H2,1-2H3,(H,20,21)