2-butylsulfanyl-6-nonyl-pyrimidine-4-carboxamide

Systemtic Name: 2-butylsulfanyl-6-nonyl-pyrimidine-4-carboxamide Openeye Name: 2-butylsulfanyl-6-nonyl-pyrimidine-4-carboxamide CAS Name: 2-(butylthio)-6-nonyl-4-pyrimidinecarboxamide IUPAC Name: 2-butylsulfanyl-6-nonylpyrimidine-4-carboxamide Traditional Name: 2-(butylthio)-6-nonyl-pyrimidine-4-carboxamide Formula: C18H31N3OS MolecularWeight: 337.52324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=NC(=NC(=C1)C(=O)N)SCCCC

Isomeric SMILES

CCCCCCCCCC1=NC(=NC(=C1)C(=O)N)SCCCC

InChI

InChI=1S/C18H31N3OS/c1-3-5-7-8-9-10-11-12-15-14-16(17(19)22)21-18(20-15)23-13-6-4-2/h14H,3-13H2,1-2H3,(H2,19,22)