ethyl 3-[4-[(5-chloranylthiophen-2-yl)methyl]-2-pyrrolidin-1-ylcarbonyl-piperazin-1-yl]-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[4-[(5-chloranylthiophen-2-yl)methyl]-2-pyrrolidin-1-ylcarbonyl-piperazin-1-yl]-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[4-[(5-chloro-2-thienyl)methyl]-2-(pyrrolidine-1-carbonyl)piperazin-1-yl]-3-oxo-propanoate CAS Name: 3-[4-[(5-chloro-2-thiophenyl)methyl]-2-[oxo(1-pyrrolidinyl)methyl]-1-piperazinyl]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[(5-chlorothiophen-2-yl)methyl]-2-(pyrrolidine-1-carbonyl)piperazin-1-yl]-3-oxopropanoate Traditional Name: 3-[4-[(5-chloro-2-thienyl)methyl]-2-(pyrrolidine-1-carbonyl)piperazino]-3-keto-propionic acid ethyl ester Formula: C19H26ClN3O4S MolecularWeight: 427.94544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)N1CCN(CC1C(=O)N2CCCC2)CC3=CC=C(S3)Cl

Isomeric SMILES

CCOC(=O)CC(=O)N1CCN(CC1C(=O)N2CCCC2)CC3=CC=C(S3)Cl

InChI

InChI=1S/C19H26ClN3O4S/c1-2-27-18(25)11-17(24)23-10-9-21(12-14-5-6-16(20)28-14)13-15(23)19(26)22-7-3-4-8-22/h5-6,15H,2-4,7-13H2,1H3