4-[3-(4-methylphenyl)-2-phenyl-1,2,4-thiadiazol-5-ylidene]morpholin-4-ium perchlorate

Systemtic Name: 4-[3-(4-methylphenyl)-2-phenyl-1,2,4-thiadiazol-5-ylidene]morpholin-4-ium perchlorate Openeye Name: 4-[2-phenyl-3-(p-tolyl)-1,2,4-thiadiazol-5-ylidene]morpholin-4-ium perchlorate CAS Name: 4-[3-(4-methylphenyl)-2-phenyl-1,2,4-thiadiazol-5-ylidene]morpholin-4-ium perchlorate IUPAC Name: 4-[3-(4-methylphenyl)-2-phenyl-1,2,4-thiadiazol-5-ylidene]morpholin-4-ium perchlorate Traditional Name: 4-[2-phenyl-3-(p-tolyl)-1,2,4-thiadiazol-5-ylidene]morpholin-4-ium perchlorate Formula: C19H20ClN3O5S MolecularWeight: 437.8972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=[N+]3CCOCC3)SN2C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=[N+]3CCOCC3)SN2C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C19H20N3OS.ClHO4/c1-15-7-9-16(10-8-15)18-20-19(21-11-13-23-14-12-21)24-22(18)17-5-3-2-4-6-17;2-1(3,4)5/h2-10H,11-14H2,1H3;(H,2,3,4,5)/q+1;/p-1