3-bromanyl-5-chloranyl-2-(3-phenylpropoxy)benzenecarbothioamide

Systemtic Name: 3-bromanyl-5-chloranyl-2-(3-phenylpropoxy)benzenecarbothioamide Openeye Name: 3-bromo-5-chloro-2-(3-phenylpropoxy)benzenecarbothioamide CAS Name: 3-bromo-5-chloro-2-(3-phenylpropoxy)benzenecarbothioamide IUPAC Name: 3-bromo-5-chloro-2-(3-phenylpropoxy)benzenecarbothioamide Traditional Name: 3-bromo-5-chloro-2-(3-phenylpropoxy)thiobenzamide Formula: C16H15BrClNOS MolecularWeight: 384.7184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2C(=S)N)Cl)Br

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2C(=S)N)Cl)Br

InChI

InChI=1S/C16H15BrClNOS/c17-14-10-12(18)9-13(16(19)21)15(14)20-8-4-7-11-5-2-1-3-6-11/h1-3,5-6,9-10H,4,7-8H2,(H2,19,21)