2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-acetamide CAS Name: 2-[[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanylacetamide Traditional Name: N-benzyl-2-[[5-(4-tert-butylbenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]acetamide Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SCC(=O)NCC2=CC=CC=C2)C)CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SCC(=O)NCC2=CC=CC=C2)C)CC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H31N3O2S/c1-18-22(15-19-11-13-21(14-12-19)26(2,3)4)24(31)29(5)25(28-18)32-17-23(30)27-16-20-9-7-6-8-10-20/h6-14H,15-17H2,1-5H3,(H,27,30)