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

Systemtic Name: 4-(4-bromophenyl)sulfanyl-N-cyclopropyl-3-nitro-benzamide Openeye Name: 4-(4-bromophenyl)sulfanyl-N-cyclopropyl-3-nitro-benzamide CAS Name: 4-[(4-bromophenyl)thio]-N-cyclopropyl-3-nitrobenzamide IUPAC Name: 4-(4-bromophenyl)sulfanyl-N-cyclopropyl-3-nitrobenzamide Traditional Name: 4-[(4-bromophenyl)thio]-N-cyclopropyl-3-nitro-benzamide Formula: C16H13BrN2O3S MolecularWeight: 393.25502

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H13BrN2O3S/c17-11-2-6-13(7-3-11)23-15-8-1-10(9-14(15)19(21)22)16(20)18-12-4-5-12/h1-3,6-9,12H,4-5H2,(H,18,20)