N-[2-(4-tert-butylphenyl)sulfanylethyl]-2-pyrimidin-5-yl-ethanethioamide

Systemtic Name: N-[2-(4-tert-butylphenyl)sulfanylethyl]-2-pyrimidin-5-yl-ethanethioamide Openeye Name: N-[2-(4-tert-butylphenyl)sulfanylethyl]-2-pyrimidin-5-yl-thioacetamide CAS Name: N-[2-[(4-tert-butylphenyl)thio]ethyl]-2-(5-pyrimidinyl)ethanethioamide IUPAC Name: N-[2-(4-tert-butylphenyl)sulfanylethyl]-2-pyrimidin-5-ylethanethioamide Traditional Name: N-[2-[(4-tert-butylphenyl)thio]ethyl]-2-(5-pyrimidyl)thioacetamide Formula: C18H23N3S2 MolecularWeight: 345.52532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCCNC(=S)CC2=CN=CN=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCCNC(=S)CC2=CN=CN=C2

InChI

InChI=1S/C18H23N3S2/c1-18(2,3)15-4-6-16(7-5-15)23-9-8-21-17(22)10-14-11-19-13-20-12-14/h4-7,11-13H,8-10H2,1-3H3,(H,21,22)