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

Systemtic Name: methyl 6-[[5-[3-(4-ethanoylpiperazin-1-yl)carbonylphenyl]sulfanyl-1,3-thiazol-2-yl]amino]pyridine-3-carboxylate Openeye Name: methyl 6-[[5-[3-(4-acetylpiperazine-1-carbonyl)phenyl]sulfanylthiazol-2-yl]amino]pyridine-3-carboxylate CAS Name: 6-[[5-[[3-[(4-acetyl-1-piperazinyl)-oxomethyl]phenyl]thio]-2-thiazolyl]amino]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[[5-[3-(4-acetylpiperazine-1-carbonyl)phenyl]sulfanyl-1,3-thiazol-2-yl]amino]pyridine-3-carboxylate Traditional Name: 6-[[5-[[3-(4-acetylpiperazine-1-carbonyl)phenyl]thio]thiazol-2-yl]amino]nicotinic acid methyl ester Formula: C23H23N5O4S2 MolecularWeight: 497.58982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)SC3=CN=C(S3)NC4=NC=C(C=C4)C(=O)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)SC3=CN=C(S3)NC4=NC=C(C=C4)C(=O)OC

InChI

InChI=1S/C23H23N5O4S2/c1-15(29)27-8-10-28(11-9-27)21(30)16-4-3-5-18(12-16)33-20-14-25-23(34-20)26-19-7-6-17(13-24-19)22(31)32-2/h3-7,12-14H,8-11H2,1-2H3,(H,24,25,26)