2-methylsulfanyl-N-(2-phenylpropyl)-4-propyl-pyrimidine-5-carboxamide

Systemtic Name: 2-methylsulfanyl-N-(2-phenylpropyl)-4-propyl-pyrimidine-5-carboxamide Openeye Name: 2-methylsulfanyl-N-(2-phenylpropyl)-4-propyl-pyrimidine-5-carboxamide CAS Name: 2-(methylthio)-N-(2-phenylpropyl)-4-propyl-5-pyrimidinecarboxamide IUPAC Name: 2-methylsulfanyl-N-(2-phenylpropyl)-4-propylpyrimidine-5-carboxamide Traditional Name: 2-(methylthio)-N-(2-phenylpropyl)-4-propyl-pyrimidine-5-carboxamide Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3OS/c1-4-8-16-15(12-20-18(21-16)23-3)17(22)19-11-13(2)14-9-6-5-7-10-14/h5-7,9-10,12-13H,4,8,11H2,1-3H3,(H,19,22)