N-[(2,5-dimethoxyphenyl)carbamothioyl]-4-hexoxy-benzamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)carbamothioyl]-4-hexoxy-benzamide Openeye Name: N-[(2,5-dimethoxyphenyl)carbamothioyl]-4-hexoxy-benzamide CAS Name: N-[(2,5-dimethoxyanilino)-sulfanylidenemethyl]-4-hexoxybenzamide IUPAC Name: N-[(2,5-dimethoxyphenyl)carbamothioyl]-4-hexoxybenzamide Traditional Name: N-[(2,5-dimethoxyphenyl)thiocarbamoyl]-4-hexoxy-benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C22H28N2O4S/c1-4-5-6-7-14-28-17-10-8-16(9-11-17)21(25)24-22(29)23-19-15-18(26-2)12-13-20(19)27-3/h8-13,15H,4-7,14H2,1-3H3,(H2,23,24,25,29)