N-[2,5-dimethoxy-4-[2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethanoylamino]phenyl]benzamide

Systemtic Name: N-[2,5-dimethoxy-4-[2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethanoylamino]phenyl]benzamide Openeye Name: N-[4-[[2-[allyl(2-thienylmethyl)amino]acetyl]amino]-2,5-dimethoxy-phenyl]benzamide CAS Name: N-[2,5-dimethoxy-4-[[1-oxo-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl]amino]phenyl]benzamide IUPAC Name: N-[2,5-dimethoxy-4-[[2-[prop-2-enyl(thiophen-2-ylmethyl)amino]acetyl]amino]phenyl]benzamide Traditional Name: N-[4-[[2-[allyl(2-thenyl)amino]acetyl]amino]-2,5-dimethoxy-phenyl]benzamide Formula: C25H27N3O4S MolecularWeight: 465.56458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CN(CC=C)CC3=CC=CS3

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CN(CC=C)CC3=CC=CS3

InChI

InChI=1S/C25H27N3O4S/c1-4-12-28(16-19-11-8-13-33-19)17-24(29)26-20-14-23(32-3)21(15-22(20)31-2)27-25(30)18-9-6-5-7-10-18/h4-11,13-15H,1,12,16-17H2,2-3H3,(H,26,29)(H,27,30)