N-[[(4-methoxyphenyl)carbonylamino]carbamothioyl]-2-pentoxy-benzamide

Systemtic Name: N-[[(4-methoxyphenyl)carbonylamino]carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[[(4-methoxybenzoyl)amino]carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[[(4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[(4-methoxybenzoyl)amino]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[(p-anisoylamino)thiocarbamoyl]benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H25N3O4S/c1-3-4-7-14-28-18-9-6-5-8-17(18)20(26)22-21(29)24-23-19(25)15-10-12-16(27-2)13-11-15/h5-6,8-13H,3-4,7,14H2,1-2H3,(H,23,25)(H2,22,24,26,29)