[4-[(2-methylsulfanyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoate

Systemtic Name: [4-[(2-methylsulfanyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoate Openeye Name: [4-[(2-methylsulfanyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 2-(4-methyl-2-oxo-chromen-7-yl)oxyacetate CAS Name: 2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]acetic acid [4-[[2-(methylthio)-6-phenyl-4-pyrimidinyl]amino]phenyl] ester IUPAC Name: [4-[(2-methylsulfanyl-6-phenylpyrimidin-4-yl)amino]phenyl] 2-(4-methyl-2-oxochromen-7-yl)oxyacetate Traditional Name: 2-(2-keto-4-methyl-chromen-7-yl)oxyacetic acid [4-[[2-(methylthio)-6-phenyl-pyrimidin-4-yl]amino]phenyl] ester Formula: C29H23N3O5S MolecularWeight: 525.57502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)OC3=CC=C(C=C3)NC4=NC(=NC(=C4)C5=CC=CC=C5)SC

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)OC3=CC=C(C=C3)NC4=NC(=NC(=C4)C5=CC=CC=C5)SC

InChI

InChI=1S/C29H23N3O5S/c1-18-14-27(33)37-25-15-22(12-13-23(18)25)35-17-28(34)36-21-10-8-20(9-11-21)30-26-16-24(31-29(32-26)38-2)19-6-4-3-5-7-19/h3-16H,17H2,1-2H3,(H,30,31,32)