3-butoxy-N-[[(4-methoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[(4-methoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[(4-methoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[[(4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[(4-methoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(p-anisoylamino)thiocarbamoyl]benzamide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H23N3O4S/c1-3-4-12-27-17-7-5-6-15(13-17)18(24)21-20(28)23-22-19(25)14-8-10-16(26-2)11-9-14/h5-11,13H,3-4,12H2,1-2H3,(H,22,25)(H2,21,23,24,28)