N-[5-chloranyl-2-(4-ethylpiperazin-1-yl)phenyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[5-chloranyl-2-(4-ethylpiperazin-1-yl)phenyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[5-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-[5-chloro-2-(4-ethyl-1-piperazinyl)phenyl]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[5-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-[5-chloro-2-(4-ethylpiperazino)phenyl]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C22H27ClN4O2S MolecularWeight: 446.99338

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3CCCN3C(=O)C4=CC=CS4

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3CCCN3C(=O)C4=CC=CS4

InChI

InChI=1S/C22H27ClN4O2S/c1-2-25-10-12-26(13-11-25)18-8-7-16(23)15-17(18)24-21(28)19-5-3-9-27(19)22(29)20-6-4-14-30-20/h4,6-8,14-15,19H,2-3,5,9-13H2,1H3,(H,24,28)