4-butylsulfanyl-2,6-dimethyl-5-(phenylmethyl)pyrimidine

Systemtic Name: 4-butylsulfanyl-2,6-dimethyl-5-(phenylmethyl)pyrimidine Openeye Name: 5-benzyl-4-butylsulfanyl-2,6-dimethyl-pyrimidine CAS Name: 4-(butylthio)-2,6-dimethyl-5-(phenylmethyl)pyrimidine IUPAC Name: 5-benzyl-4-butylsulfanyl-2,6-dimethylpyrimidine Traditional Name: 5-benzyl-4-(butylthio)-2,6-dimethyl-pyrimidine Formula: C17H22N2S MolecularWeight: 286.43498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=NC(=C1CC2=CC=CC=C2)C)C

Isomeric SMILES

CCCCSC1=NC(=NC(=C1CC2=CC=CC=C2)C)C

InChI

InChI=1S/C17H22N2S/c1-4-5-11-20-17-16(13(2)18-14(3)19-17)12-15-9-7-6-8-10-15/h6-10H,4-5,11-12H2,1-3H3