N,N-diethyl-4-[piperidin-4-ylidene-[3-(thiophen-2-ylmethylamino)phenyl]methyl]benzamide

Systemtic Name: N,N-diethyl-4-[piperidin-4-ylidene-[3-(thiophen-2-ylmethylamino)phenyl]methyl]benzamide Openeye Name: N,N-diethyl-4-[4-piperidylidene-[3-(2-thienylmethylamino)phenyl]methyl]benzamide CAS Name: N,N-diethyl-4-[4-piperidinylidene-[3-(thiophen-2-ylmethylamino)phenyl]methyl]benzamide IUPAC Name: N,N-diethyl-4-[piperidin-4-ylidene-[3-(thiophen-2-ylmethylamino)phenyl]methyl]benzamide Traditional Name: N,N-diethyl-4-[4-piperidylidene-[3-(2-thenylamino)phenyl]methyl]benzamide Formula: C28H33N3OS MolecularWeight: 459.64612

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CCNCC2)C3=CC(=CC=C3)NCC4=CC=CS4

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CCNCC2)C3=CC(=CC=C3)NCC4=CC=CS4

InChI

InChI=1S/C28H33N3OS/c1-3-31(4-2)28(32)23-12-10-21(11-13-23)27(22-14-16-29-17-15-22)24-7-5-8-25(19-24)30-20-26-9-6-18-33-26/h5-13,18-19,29-30H,3-4,14-17,20H2,1-2H3