2-[2-(4-methoxyphenyl)ethanoylcarbamothioyl-methyl-amino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[2-(4-methoxyphenyl)ethanoylcarbamothioyl-methyl-amino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[[2-(4-methoxyphenyl)acetyl]carbamothioyl-methyl-amino]benzamide CAS Name: 2-[[[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]-methylamino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[[2-(4-methoxyphenyl)acetyl]carbamothioyl-methylamino]benzamide Traditional Name: N-benzyl-2-[[2-(4-methoxyphenyl)acetyl]thiocarbamoyl-methyl-amino]benzamide Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NCC2=CC=CC=C2)C(=S)NC(=O)CC3=CC=C(C=C3)OC

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NCC2=CC=CC=C2)C(=S)NC(=O)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C25H25N3O3S/c1-28(25(32)27-23(29)16-18-12-14-20(31-2)15-13-18)22-11-7-6-10-21(22)24(30)26-17-19-8-4-3-5-9-19/h3-15H,16-17H2,1-2H3,(H,26,30)(H,27,29,32)