(3E)-3-[5-(4-bromophenyl)-1,3-oxathiol-2-ylidene]-1-methyl-indolizin-2-one

Systemtic Name: (3E)-3-[5-(4-bromophenyl)-1,3-oxathiol-2-ylidene]-1-methyl-indolizin-2-one Openeye Name: (3E)-3-[5-(4-bromophenyl)-1,3-oxathiol-2-ylidene]-1-methyl-indolizin-2-one CAS Name: (3E)-3-[5-(4-bromophenyl)-1,3-oxathiol-2-ylidene]-1-methyl-2-indolizinone IUPAC Name: (3E)-3-[5-(4-bromophenyl)-1,3-oxathiol-2-ylidene]-1-methylindolizin-2-one Traditional Name: (3E)-3-[5-(4-bromophenyl)-1,3-oxathiol-2-ylidene]-1-methyl-indolizin-2-one Formula: C18H12BrNO2S MolecularWeight: 386.26238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=CN2C(=C3OC(=CS3)C4=CC=C(C=C4)Br)C1=O

Isomeric SMILES

CC1=C2C=CC=CN2/C(=C/3\OC(=CS3)C4=CC=C(C=C4)Br)/C1=O

InChI

InChI=1S/C18H12BrNO2S/c1-11-14-4-2-3-9-20(14)16(17(11)21)18-22-15(10-23-18)12-5-7-13(19)8-6-12/h2-10H,1H3/b18-16+