N-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]-3,4,5-triethoxy-benzamide

Systemtic Name: N-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]-3,4,5-triethoxy-benzamide Openeye Name: N-[(3-chloro-2-methyl-phenyl)carbamothioyl]-3,4,5-triethoxy-benzamide CAS Name: N-[(3-chloro-2-methylanilino)-sulfanylidenemethyl]-3,4,5-triethoxybenzamide IUPAC Name: N-[(3-chloro-2-methylphenyl)carbamothioyl]-3,4,5-triethoxybenzamide Traditional Name: N-[(3-chloro-2-methyl-phenyl)thiocarbamoyl]-3,4,5-triethoxy-benzamide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=C(C(=CC=C2)Cl)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=C(C(=CC=C2)Cl)C

InChI

InChI=1S/C21H25ClN2O4S/c1-5-26-17-11-14(12-18(27-6-2)19(17)28-7-3)20(25)24-21(29)23-16-10-8-9-15(22)13(16)4/h8-12H,5-7H2,1-4H3,(H2,23,24,25,29)