N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-propanamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-propanamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-propanamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-methylpropanamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-methylpropanamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-methyl-propionamide Formula: C20H25BrN4O2S MolecularWeight: 465.4071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)CCC2=C(N=C(N=C2C)SC)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)CCC2=C(N=C(N=C2C)SC)C

InChI

InChI=1S/C20H25BrN4O2S/c1-12-10-15(21)6-8-17(12)24-18(26)11-25(4)19(27)9-7-16-13(2)22-20(28-5)23-14(16)3/h6,8,10H,7,9,11H2,1-5H3,(H,24,26)