(5Z)-5-[[1-[(4-bromophenyl)methyl]indol-3-yl]methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5Z)-5-[[1-[(4-bromophenyl)methyl]indol-3-yl]methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-5-[[1-[(4-bromophenyl)methyl]indol-3-yl]methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-5-[[1-[(4-bromophenyl)methyl]-3-indolyl]methylidene]-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-5-[[1-[(4-bromophenyl)methyl]indol-3-yl]methylidene]-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-5-[[1-(4-bromobenzyl)indol-3-yl]methylene]-6-keto-2-thioxo-pyrimidin-4-olate Formula: C20H13BrN3O2S- MolecularWeight: 439.30512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)Br)C=C4C(=O)NC(=S)N=C4[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)Br)/C=C/4\C(=O)NC(=S)N=C4[O-]

InChI

InChI=1S/C20H14BrN3O2S/c21-14-7-5-12(6-8-14)10-24-11-13(15-3-1-2-4-17(15)24)9-16-18(25)22-20(27)23-19(16)26/h1-9,11H,10H2,(H2,22,23,25,26,27)/p-1