methyl 4-methyl-6-[2-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-2-oxidanylidene-ethyl]sulfanyl-2-propan-2-yl-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-methyl-6-[2-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-2-oxidanylidene-ethyl]sulfanyl-2-propan-2-yl-pyrimidine-5-carboxylate Openeye Name: methyl 2-isopropyl-4-methyl-6-[2-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-6-[[2-[methyl-[(1-phenyl-4-pyrazolyl)methyl]amino]-2-oxoethyl]thio]-2-propan-2-yl-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-6-[2-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-2-oxoethyl]sulfanyl-2-propan-2-ylpyrimidine-5-carboxylate Traditional Name: 2-isopropyl-4-[[2-keto-2-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]ethyl]thio]-6-methyl-pyrimidine-5-carboxylic acid methyl ester Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C(C)C)SCC(=O)N(C)CC2=CN(N=C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)C(C)C)SCC(=O)N(C)CC2=CN(N=C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C23H27N5O3S/c1-15(2)21-25-16(3)20(23(30)31-5)22(26-21)32-14-19(29)27(4)12-17-11-24-28(13-17)18-9-7-6-8-10-18/h6-11,13,15H,12,14H2,1-5H3