ethyl 4-[2-[(2,5-dimethylpiperazin-1-yl)-(3-hydroxyphenyl)methyl]phenyl]-5H-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 4-[2-[(2,5-dimethylpiperazin-1-yl)-(3-hydroxyphenyl)methyl]phenyl]-5H-1,3-thiazole-4-carboxylate Openeye Name: ethyl 4-[2-[(2,5-dimethylpiperazin-1-yl)-(3-hydroxyphenyl)methyl]phenyl]-5H-thiazole-4-carboxylate CAS Name: 4-[2-[(2,5-dimethyl-1-piperazinyl)-(3-hydroxyphenyl)methyl]phenyl]-5H-thiazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(2,5-dimethylpiperazin-1-yl)-(3-hydroxyphenyl)methyl]phenyl]-5H-1,3-thiazole-4-carboxylate Traditional Name: 4-[2-[(2,5-dimethylpiperazino)-(3-hydroxyphenyl)methyl]phenyl]-2-thiazoline-4-carboxylic acid ethyl ester Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CSC=N1)C2=CC=CC=C2C(C3=CC(=CC=C3)O)N4CC(NCC4C)C

Isomeric SMILES

CCOC(=O)C1(CSC=N1)C2=CC=CC=C2C(C3=CC(=CC=C3)O)N4CC(NCC4C)C

InChI

InChI=1S/C25H31N3O3S/c1-4-31-24(30)25(15-32-16-27-25)22-11-6-5-10-21(22)23(19-8-7-9-20(29)12-19)28-14-17(2)26-13-18(28)3/h5-12,16-18,23,26,29H,4,13-15H2,1-3H3