N-[(4-methylphenyl)methyl]-2-[2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethanoylamino]benzamide

Systemtic Name: N-[(4-methylphenyl)methyl]-2-[2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethanoylamino]benzamide Openeye Name: 2-[[2-[allyl(2-thienylmethyl)amino]acetyl]amino]-N-(p-tolylmethyl)benzamide CAS Name: N-[(4-methylphenyl)methyl]-2-[[1-oxo-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl]amino]benzamide IUPAC Name: N-[(4-methylphenyl)methyl]-2-[[2-[prop-2-enyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide Traditional Name: 2-[[2-[allyl(2-thenyl)amino]acetyl]amino]-N-(4-methylbenzyl)benzamide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=O)CN(CC=C)CC3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=O)CN(CC=C)CC3=CC=CS3

InChI

InChI=1S/C25H27N3O2S/c1-3-14-28(17-21-7-6-15-31-21)18-24(29)27-23-9-5-4-8-22(23)25(30)26-16-20-12-10-19(2)11-13-20/h3-13,15H,1,14,16-18H2,2H3,(H,26,30)(H,27,29)