dimethyl-[4-(2-phenyl-6-pyrimidin-2-yl-thiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]azanium perchlorate

Systemtic Name: dimethyl-[4-(2-phenyl-6-pyrimidin-2-yl-thiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]azanium perchlorate Openeye Name: dimethyl-[4-(2-phenyl-6-pyrimidin-2-yl-thiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]ammonium perchlorate CAS Name: dimethyl-[4-[2-phenyl-6-(2-pyrimidinyl)-4-thiopyranylidene]-1-cyclohexa-2,5-dienylidene]ammonium perchlorate IUPAC Name: dimethyl-[4-(2-phenyl-6-pyrimidin-2-ylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]azanium perchlorate Traditional Name: dimethyl-[4-[2-phenyl-6-(2-pyrimidyl)thiopyran-4-ylidene]cyclohexa-2,5-dien-1-ylidene]ammonium perchlorate Formula: C23H20ClN3O4S MolecularWeight: 469.9406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](=C1C=CC(=C2C=C(SC(=C2)C3=NC=CC=N3)C4=CC=CC=C4)C=C1)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+](=C1C=CC(=C2C=C(SC(=C2)C3=NC=CC=N3)C4=CC=CC=C4)C=C1)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C23H20N3S.ClHO4/c1-26(2)20-11-9-17(10-12-20)19-15-21(18-7-4-3-5-8-18)27-22(16-19)23-24-13-6-14-25-23;2-1(3,4)5/h3-16H,1-2H3;(H,2,3,4,5)/q+1;/p-1