3,4-dimethyl-N-[(Z)-3-oxidanylidene-3-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]-1-thiophen-2-yl-prop-1-en-2-yl]benzamide

Systemtic Name: 3,4-dimethyl-N-[(Z)-3-oxidanylidene-3-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]-1-thiophen-2-yl-prop-1-en-2-yl]benzamide Openeye Name: N-[(Z)-1-[(1-benzylpiperidin-1-ium-4-yl)carbamoyl]-2-(2-thienyl)vinyl]-3,4-dimethyl-benzamide CAS Name: 3,4-dimethyl-N-[(Z)-3-oxo-3-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]-1-thiophen-2-ylprop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-3-[(1-benzylpiperidin-1-ium-4-yl)amino]-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]-3,4-dimethylbenzamide Traditional Name: N-[(Z)-1-[(1-benzylpiperidin-1-ium-4-yl)carbamoyl]-2-(2-thienyl)vinyl]-3,4-dimethyl-benzamide Formula: C28H32N3O2S+ MolecularWeight: 474.63758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=CC2=CC=CS2)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N/C(=C\C2=CC=CS2)/C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C28H31N3O2S/c1-20-10-11-23(17-21(20)2)27(32)30-26(18-25-9-6-16-34-25)28(33)29-24-12-14-31(15-13-24)19-22-7-4-3-5-8-22/h3-11,16-18,24H,12-15,19H2,1-2H3,(H,29,33)(H,30,32)/p+1/b26-18-