4-(4-bromophenyl)sulfanyl-3-(propanoylamino)benzoate

Systemtic Name: 4-(4-bromophenyl)sulfanyl-3-(propanoylamino)benzoate Openeye Name: 4-(4-bromophenyl)sulfanyl-3-(propanoylamino)benzoate CAS Name: 4-[(4-bromophenyl)thio]-3-(1-oxopropylamino)benzoate IUPAC Name: 4-(4-bromophenyl)sulfanyl-3-(propanoylamino)benzoate Traditional Name: 4-[(4-bromophenyl)thio]-3-propionamido-benzoate Formula: C16H13BrNO3S- MolecularWeight: 379.24832

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=CC(=C1)C(=O)[O-])SC2=CC=C(C=C2)Br

Isomeric SMILES

CCC(=O)NC1=C(C=CC(=C1)C(=O)[O-])SC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H14BrNO3S/c1-2-15(19)18-13-9-10(16(20)21)3-8-14(13)22-12-6-4-11(17)5-7-12/h3-9H,2H2,1H3,(H,18,19)(H,20,21)/p-1