2-methylsulfanyl-N-(1-phenylethyl)-4-propyl-pyrimidine-5-carboxamide

Systemtic Name: 2-methylsulfanyl-N-(1-phenylethyl)-4-propyl-pyrimidine-5-carboxamide Openeye Name: 2-methylsulfanyl-N-(1-phenylethyl)-4-propyl-pyrimidine-5-carboxamide CAS Name: 2-(methylthio)-N-(1-phenylethyl)-4-propyl-5-pyrimidinecarboxamide IUPAC Name: 2-methylsulfanyl-N-(1-phenylethyl)-4-propylpyrimidine-5-carboxamide Traditional Name: 2-(methylthio)-N-(1-phenylethyl)-4-propyl-pyrimidine-5-carboxamide Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NC=C1C(=O)NC(C)C2=CC=CC=C2)SC

Isomeric SMILES

CCCC1=NC(=NC=C1C(=O)NC(C)C2=CC=CC=C2)SC

InChI

InChI=1S/C17H21N3OS/c1-4-8-15-14(11-18-17(20-15)22-3)16(21)19-12(2)13-9-6-5-7-10-13/h5-7,9-12H,4,8H2,1-3H3,(H,19,21)