N-[[2-(4-methoxyphenyl)ethanoylamino]carbamothioyl]-3-(2-methylpropoxy)benzamide

Systemtic Name: N-[[2-(4-methoxyphenyl)ethanoylamino]carbamothioyl]-3-(2-methylpropoxy)benzamide Openeye Name: 3-isobutoxy-N-[[[2-(4-methoxyphenyl)acetyl]amino]carbamothioyl]benzamide CAS Name: N-[[[2-(4-methoxyphenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-(2-methylpropoxy)benzamide IUPAC Name: N-[[[2-(4-methoxyphenyl)acetyl]amino]carbamothioyl]-3-(2-methylpropoxy)benzamide Traditional Name: 3-isobutoxy-N-[[[2-(4-methoxyphenyl)acetyl]amino]thiocarbamoyl]benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)CC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H25N3O4S/c1-14(2)13-28-18-6-4-5-16(12-18)20(26)22-21(29)24-23-19(25)11-15-7-9-17(27-3)10-8-15/h4-10,12,14H,11,13H2,1-3H3,(H,23,25)(H2,22,24,26,29)