N,N-diethyl-4-[(R)-piperazin-1-yl-[3-(thiophen-2-ylmethylamino)phenyl]methyl]benzamide

Systemtic Name: N,N-diethyl-4-[(R)-piperazin-1-yl-[3-(thiophen-2-ylmethylamino)phenyl]methyl]benzamide Openeye Name: N,N-diethyl-4-[(R)-piperazin-1-yl-[3-(2-thienylmethylamino)phenyl]methyl]benzamide CAS Name: N,N-diethyl-4-[(R)-1-piperazinyl-[3-(thiophen-2-ylmethylamino)phenyl]methyl]benzamide IUPAC Name: N,N-diethyl-4-[(R)-piperazin-1-yl-[3-(thiophen-2-ylmethylamino)phenyl]methyl]benzamide Traditional Name: N,N-diethyl-4-[(R)-piperazino-[3-(2-thenylamino)phenyl]methyl]benzamide Formula: C27H34N4OS MolecularWeight: 462.65006

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC(=CC=C2)NCC3=CC=CS3)N4CCNCC4

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)[C@H](C2=CC(=CC=C2)NCC3=CC=CS3)N4CCNCC4

InChI

InChI=1S/C27H34N4OS/c1-3-30(4-2)27(32)22-12-10-21(11-13-22)26(31-16-14-28-15-17-31)23-7-5-8-24(19-23)29-20-25-9-6-18-33-25/h5-13,18-19,26,28-29H,3-4,14-17,20H2,1-2H3/t26-/m1/s1