methyl 6-[[5-[3-(4-ethanoylpiperazin-1-yl)carbonyl-4-oxidanyl-phenyl]sulfanyl-1,3-thiazol-2-yl]amino]pyridine-2-carboxylate

Systemtic Name: methyl 6-[[5-[3-(4-ethanoylpiperazin-1-yl)carbonyl-4-oxidanyl-phenyl]sulfanyl-1,3-thiazol-2-yl]amino]pyridine-2-carboxylate Openeye Name: methyl 6-[[5-[3-(4-acetylpiperazine-1-carbonyl)-4-hydroxy-phenyl]sulfanylthiazol-2-yl]amino]pyridine-2-carboxylate CAS Name: 6-[[5-[[3-[(4-acetyl-1-piperazinyl)-oxomethyl]-4-hydroxyphenyl]thio]-2-thiazolyl]amino]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[[5-[3-(4-acetylpiperazine-1-carbonyl)-4-hydroxyphenyl]sulfanyl-1,3-thiazol-2-yl]amino]pyridine-2-carboxylate Traditional Name: 6-[[5-[[3-(4-acetylpiperazine-1-carbonyl)-4-hydroxy-phenyl]thio]thiazol-2-yl]amino]picolinic acid methyl ester Formula: C23H23N5O5S2 MolecularWeight: 513.58922

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)SC3=CN=C(S3)NC4=CC=CC(=N4)C(=O)OC)O

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)SC3=CN=C(S3)NC4=CC=CC(=N4)C(=O)OC)O

InChI

InChI=1S/C23H23N5O5S2/c1-14(29)27-8-10-28(11-9-27)21(31)16-12-15(6-7-18(16)30)34-20-13-24-23(35-20)26-19-5-3-4-17(25-19)22(32)33-2/h3-7,12-13,30H,8-11H2,1-2H3,(H,24,25,26)