4-[[4-(diethylcarbamoyl)phenyl]-[1-(thiophen-2-ylmethyl)piperidin-4-ylidene]methyl]benzamide

Systemtic Name: 4-[[4-(diethylcarbamoyl)phenyl]-[1-(thiophen-2-ylmethyl)piperidin-4-ylidene]methyl]benzamide Openeye Name: 4-[[4-(diethylcarbamoyl)phenyl]-[1-(2-thienylmethyl)-4-piperidylidene]methyl]benzamide CAS Name: 4-[[4-[diethylamino(oxo)methyl]phenyl]-[1-(thiophen-2-ylmethyl)-4-piperidinylidene]methyl]benzamide IUPAC Name: 4-[[4-(diethylcarbamoyl)phenyl]-[1-(thiophen-2-ylmethyl)piperidin-4-ylidene]methyl]benzamide Traditional Name: 4-[[4-(diethylcarbamoyl)phenyl]-[1-(2-thenyl)-4-piperidylidene]methyl]benzamide Formula: C29H33N3O2S MolecularWeight: 487.65622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CCN(CC2)CC3=CC=CS3)C4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CCN(CC2)CC3=CC=CS3)C4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C29H33N3O2S/c1-3-32(4-2)29(34)25-13-9-22(10-14-25)27(21-7-11-24(12-8-21)28(30)33)23-15-17-31(18-16-23)20-26-6-5-19-35-26/h5-14,19H,3-4,15-18,20H2,1-2H3,(H2,30,33)