N-butan-2-yl-2-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]benzamide

Systemtic Name: N-butan-2-yl-2-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]benzamide Openeye Name: 2-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-[[[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butan-2-yl-2-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]benzamide Traditional Name: 2-[[2-(4-methoxyphenyl)acetyl]thiocarbamoylamino]-N-sec-butyl-benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NC(=S)NC(=O)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCC(C)NC(=O)C1=CC=CC=C1NC(=S)NC(=O)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H25N3O3S/c1-4-14(2)22-20(26)17-7-5-6-8-18(17)23-21(28)24-19(25)13-15-9-11-16(27-3)12-10-15/h5-12,14H,4,13H2,1-3H3,(H,22,26)(H2,23,24,25,28)