tert-butyl 4-[4-(4-methoxyphenyl)-5-(2-methylsulfanylpyrimidin-4-yl)-1,3-thiazol-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(4-methoxyphenyl)-5-(2-methylsulfanylpyrimidin-4-yl)-1,3-thiazol-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(4-methoxyphenyl)-5-(2-methylsulfanylpyrimidin-4-yl)thiazol-2-yl]piperazine-1-carboxylate CAS Name: 4-[4-(4-methoxyphenyl)-5-[2-(methylthio)-4-pyrimidinyl]-2-thiazolyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(4-methoxyphenyl)-5-(2-methylsulfanylpyrimidin-4-yl)-1,3-thiazol-2-yl]piperazine-1-carboxylate Traditional Name: 4-[4-(4-methoxyphenyl)-5-[2-(methylthio)pyrimidin-4-yl]thiazol-2-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H29N5O3S2 MolecularWeight: 499.64876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=C(S2)C3=NC(=NC=C3)SC)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=C(S2)C3=NC(=NC=C3)SC)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H29N5O3S2/c1-24(2,3)32-23(30)29-14-12-28(13-15-29)22-27-19(16-6-8-17(31-4)9-7-16)20(34-22)18-10-11-25-21(26-18)33-5/h6-11H,12-15H2,1-5H3