2,4-bis(chloranyl)-N-[(4-heptoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[(4-heptoxyphenyl)carbamothioyl]benzamide Openeye Name: 2,4-dichloro-N-[(4-heptoxyphenyl)carbamothioyl]benzamide CAS Name: 2,4-dichloro-N-[(4-heptoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[(4-heptoxyphenyl)carbamothioyl]benzamide Traditional Name: 2,4-dichloro-N-[(4-heptoxyphenyl)thiocarbamoyl]benzamide Formula: C21H24Cl2N2O2S MolecularWeight: 439.39846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24Cl2N2O2S/c1-2-3-4-5-6-13-27-17-10-8-16(9-11-17)24-21(28)25-20(26)18-12-7-15(22)14-19(18)23/h7-12,14H,2-6,13H2,1H3,(H2,24,25,26,28)