N-[(4-tert-butylphenyl)methyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-propanamide

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-propanamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-propanamide CAS Name: N-[(4-tert-butylphenyl)methyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-methylpropanamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-methylpropanamide Traditional Name: N-(4-tert-butylbenzyl)-3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-methyl-propionamide Formula: C22H31N3OS MolecularWeight: 385.56604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N(C)CC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N(C)CC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H31N3OS/c1-15-19(16(2)24-21(23-15)27-7)12-13-20(26)25(6)14-17-8-10-18(11-9-17)22(3,4)5/h8-11H,12-14H2,1-7H3