N-[3-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]-2-methyl-phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]-2-methyl-phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]-2-methyl-phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-2-methylphenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]-2-methylphenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[2-(4-methoxyphenyl)acetyl]thiocarbamoylamino]-2-methyl-phenyl]cyclopropanecarboxamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=S)NC(=O)CC2=CC=C(C=C2)OC)NC(=O)C3CC3

Isomeric SMILES

CC1=C(C=CC=C1NC(=S)NC(=O)CC2=CC=C(C=C2)OC)NC(=O)C3CC3

InChI

InChI=1S/C21H23N3O3S/c1-13-17(22-20(26)15-8-9-15)4-3-5-18(13)23-21(28)24-19(25)12-14-6-10-16(27-2)11-7-14/h3-7,10-11,15H,8-9,12H2,1-2H3,(H,22,26)(H2,23,24,25,28)