4-(4-bromophenyl)sulfanyl-N-[(3,4-dichlorophenyl)methyl]-3-nitro-benzamide

Systemtic Name: 4-(4-bromophenyl)sulfanyl-N-[(3,4-dichlorophenyl)methyl]-3-nitro-benzamide Openeye Name: 4-(4-bromophenyl)sulfanyl-N-[(3,4-dichlorophenyl)methyl]-3-nitro-benzamide CAS Name: 4-[(4-bromophenyl)thio]-N-[(3,4-dichlorophenyl)methyl]-3-nitrobenzamide IUPAC Name: 4-(4-bromophenyl)sulfanyl-N-[(3,4-dichlorophenyl)methyl]-3-nitrobenzamide Traditional Name: 4-[(4-bromophenyl)thio]-N-(3,4-dichlorobenzyl)-3-nitro-benzamide Formula: C20H13BrCl2N2O3S MolecularWeight: 512.20382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SC2=C(C=C(C=C2)C(=O)NCC3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1SC2=C(C=C(C=C2)C(=O)NCC3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-])Br

InChI

InChI=1S/C20H13BrCl2N2O3S/c21-14-3-5-15(6-4-14)29-19-8-2-13(10-18(19)25(27)28)20(26)24-11-12-1-7-16(22)17(23)9-12/h1-10H,11H2,(H,24,26)