ethyl 4-methyl-2-[2-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]ethanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[2-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]ethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[[2-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]acetyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[2-[4-[[4-(methylthio)phenyl]methyl]-1-piperazinyl]-1-oxoethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[2-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]acetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[2-[4-[4-(methylthio)benzyl]piperazino]acetyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C21H28N4O3S2 MolecularWeight: 448.60202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CN2CCN(CC2)CC3=CC=C(C=C3)SC)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CN2CCN(CC2)CC3=CC=C(C=C3)SC)C

InChI

InChI=1S/C21H28N4O3S2/c1-4-28-20(27)19-15(2)22-21(30-19)23-18(26)14-25-11-9-24(10-12-25)13-16-5-7-17(29-3)8-6-16/h5-8H,4,9-14H2,1-3H3,(H,22,23,26)