N-[(2-butoxyphenyl)carbamothioyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[(2-butoxyphenyl)carbamothioyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[(2-butoxyphenyl)carbamothioyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[(2-butoxyanilino)-sulfanylidenemethyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[(2-butoxyphenyl)carbamothioyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[(2-butoxyphenyl)thiocarbamoyl]-3,4,5-trimethoxy-benzamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1NC(=S)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CCCCOC1=CC=CC=C1NC(=S)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C21H26N2O5S/c1-5-6-11-28-16-10-8-7-9-15(16)22-21(29)23-20(24)14-12-17(25-2)19(27-4)18(13-14)26-3/h7-10,12-13H,5-6,11H2,1-4H3,(H2,22,23,24,29)