methyl 6-[[4-(5-methyl-3-methylsulfanyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]amino]naphthalene-2-carboxylate

Systemtic Name: methyl 6-[[4-(5-methyl-3-methylsulfanyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]amino]naphthalene-2-carboxylate Openeye Name: methyl 6-[[4-(5-methyl-3-methylsulfanyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]amino]naphthalene-2-carboxylate CAS Name: 6-[[4-[5-methyl-3-(methylthio)-1-phenyl-4-pyrazolyl]-2-pyrimidinyl]amino]-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 6-[[4-(5-methyl-3-methylsulfanyl-1-phenylpyrazol-4-yl)pyrimidin-2-yl]amino]naphthalene-2-carboxylate Traditional Name: 6-[[4-[5-methyl-3-(methylthio)-1-phenyl-pyrazol-4-yl]pyrimidin-2-yl]amino]naphthalene-2-carboxylic acid methyl ester Formula: C27H23N5O2S MolecularWeight: 481.56882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)SC)C3=NC(=NC=C3)NC4=CC5=C(C=C4)C=C(C=C5)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)SC)C3=NC(=NC=C3)NC4=CC5=C(C=C4)C=C(C=C5)C(=O)OC

InChI

InChI=1S/C27H23N5O2S/c1-17-24(25(35-3)31-32(17)22-7-5-4-6-8-22)23-13-14-28-27(30-23)29-21-12-11-18-15-20(26(33)34-2)10-9-19(18)16-21/h4-16H,1-3H3,(H,28,29,30)