3-bromanyl-N-[(3-chloranyl-4-methyl-phenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide

Systemtic Name: 3-bromanyl-N-[(3-chloranyl-4-methyl-phenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide Openeye Name: 3-bromo-N-[(3-chloro-4-methyl-phenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-N-[(3-chloro-4-methylanilino)-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: 3-bromo-N-[(3-chloro-4-methylphenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: 3-bromo-N-[(3-chloro-4-methyl-phenyl)thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C18H18BrClN2O3S MolecularWeight: 457.76912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCOC)Br)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCOC)Br)Cl

InChI

InChI=1S/C18H18BrClN2O3S/c1-11-3-5-13(10-15(11)20)21-18(26)22-17(23)12-4-6-16(14(19)9-12)25-8-7-24-2/h3-6,9-10H,7-8H2,1-2H3,(H2,21,22,23,26)