N-[(4-heptoxyphenyl)carbamothioyl]-2-methoxy-benzamide

Systemtic Name: N-[(4-heptoxyphenyl)carbamothioyl]-2-methoxy-benzamide Openeye Name: N-[(4-heptoxyphenyl)carbamothioyl]-2-methoxy-benzamide CAS Name: N-[(4-heptoxyanilino)-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: N-[(4-heptoxyphenyl)carbamothioyl]-2-methoxybenzamide Traditional Name: N-[(4-heptoxyphenyl)thiocarbamoyl]-2-methoxy-benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2OC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2OC

InChI

InChI=1S/C22H28N2O3S/c1-3-4-5-6-9-16-27-18-14-12-17(13-15-18)23-22(28)24-21(25)19-10-7-8-11-20(19)26-2/h7-8,10-15H,3-6,9,16H2,1-2H3,(H2,23,24,25,28)