(4-bromophenyl)-[2-(phenylmethyl)-5-sulfanylidene-1,3,4-oxadiazin-4-yl]methanone

Systemtic Name: (4-bromophenyl)-[2-(phenylmethyl)-5-sulfanylidene-1,3,4-oxadiazin-4-yl]methanone Openeye Name: (2-benzyl-5-thioxo-1,3,4-oxadiazin-4-yl)-(4-bromophenyl)methanone CAS Name: (4-bromophenyl)-[2-(phenylmethyl)-5-sulfanylidene-1,3,4-oxadiazin-4-yl]methanone IUPAC Name: (2-benzyl-5-sulfanylidene-1,3,4-oxadiazin-4-yl)-(4-bromophenyl)methanone Traditional Name: (2-benzyl-5-thioxo-1,3,4-oxadiazin-4-yl)-(4-bromophenyl)methanone Formula: C17H13BrN2O2S MolecularWeight: 389.26632

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=S)N(N=C(O1)CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1C(=S)N(N=C(O1)CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H13BrN2O2S/c18-14-8-6-13(7-9-14)17(21)20-16(23)11-22-15(19-20)10-12-4-2-1-3-5-12/h1-9H,10-11H2