4-chloranyl-N-[4-oxidanylidene-4-[(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)amino]butyl]benzamide

Systemtic Name: 4-chloranyl-N-[4-oxidanylidene-4-[(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)amino]butyl]benzamide Openeye Name: 4-chloro-N-[4-oxo-4-[[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]amino]butyl]benzamide CAS Name: 4-chloro-N-[4-oxo-4-[[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]amino]butyl]benzamide IUPAC Name: 4-chloro-N-[4-oxo-4-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]butyl]benzamide Traditional Name: 4-chloro-N-[4-keto-4-[[2-pyrrolidino-2-(2-thienyl)ethyl]amino]butyl]benzamide Formula: C21H26ClN3O2S MolecularWeight: 419.96804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)CCCNC(=O)C2=CC=C(C=C2)Cl)C3=CC=CS3

Isomeric SMILES

C1CCN(C1)C(CNC(=O)CCCNC(=O)C2=CC=C(C=C2)Cl)C3=CC=CS3

InChI

InChI=1S/C21H26ClN3O2S/c22-17-9-7-16(8-10-17)21(27)23-11-3-6-20(26)24-15-18(19-5-4-14-28-19)25-12-1-2-13-25/h4-5,7-10,14,18H,1-3,6,11-13,15H2,(H,23,27)(H,24,26)