N-[2-(2,4,6-trimethylphenoxy)ethyl]pyrimidine-5-carbothioamide

Systemtic Name: N-[2-(2,4,6-trimethylphenoxy)ethyl]pyrimidine-5-carbothioamide Openeye Name: N-[2-(2,4,6-trimethylphenoxy)ethyl]pyrimidine-5-carbothioamide CAS Name: N-[2-(2,4,6-trimethylphenoxy)ethyl]-5-pyrimidinecarbothioamide IUPAC Name: N-[2-(2,4,6-trimethylphenoxy)ethyl]pyrimidine-5-carbothioamide Traditional Name: N-[2-(2,4,6-trimethylphenoxy)ethyl]pyrimidine-5-carbothioamide Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCCNC(=S)C2=CN=CN=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCCNC(=S)C2=CN=CN=C2)C

InChI

InChI=1S/C16H19N3OS/c1-11-6-12(2)15(13(3)7-11)20-5-4-19-16(21)14-8-17-10-18-9-14/h6-10H,4-5H2,1-3H3,(H,19,21)