4-(4-bromophenyl)sulfanyl-N-(3-ethoxypropyl)-3-nitro-benzamide

Systemtic Name: 4-(4-bromophenyl)sulfanyl-N-(3-ethoxypropyl)-3-nitro-benzamide Openeye Name: 4-(4-bromophenyl)sulfanyl-N-(3-ethoxypropyl)-3-nitro-benzamide CAS Name: 4-[(4-bromophenyl)thio]-N-(3-ethoxypropyl)-3-nitrobenzamide IUPAC Name: 4-(4-bromophenyl)sulfanyl-N-(3-ethoxypropyl)-3-nitrobenzamide Traditional Name: 4-[(4-bromophenyl)thio]-N-(3-ethoxypropyl)-3-nitro-benzamide Formula: C18H19BrN2O4S MolecularWeight: 439.32346

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=CC(=C(C=C1)SC2=CC=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CCOCCCNC(=O)C1=CC(=C(C=C1)SC2=CC=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H19BrN2O4S/c1-2-25-11-3-10-20-18(22)13-4-9-17(16(12-13)21(23)24)26-15-7-5-14(19)6-8-15/h4-9,12H,2-3,10-11H2,1H3,(H,20,22)