ethyl 2-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]ethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]acetyl]amino]benzoate CAS Name: 2-[[2-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]acetyl]amino]benzoate Traditional Name: 2-[[2-[4-[(5-chloro-2-thienyl)methyl]piperazino]acetyl]amino]benzoic acid ethyl ester Formula: C20H24ClN3O3S MolecularWeight: 421.94086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)CN2CCN(CC2)CC3=CC=C(S3)Cl

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)CN2CCN(CC2)CC3=CC=C(S3)Cl

InChI

InChI=1S/C20H24ClN3O3S/c1-2-27-20(26)16-5-3-4-6-17(16)22-19(25)14-24-11-9-23(10-12-24)13-15-7-8-18(21)28-15/h3-8H,2,9-14H2,1H3,(H,22,25)