4,4-dimethyl-1-[4-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]pyrazolidin-3-one

Systemtic Name: 4,4-dimethyl-1-[4-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]pyrazolidin-3-one Openeye Name: 4,4-dimethyl-1-[4-(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)phenyl]pyrazolidin-3-one CAS Name: 4,4-dimethyl-1-[4-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]-3-pyrazolidinone IUPAC Name: 4,4-dimethyl-1-[4-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]pyrazolidin-3-one Traditional Name: 4,4-dimethyl-1-[4-(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)phenyl]pyrazolidin-3-one Formula: C19H19N5OS MolecularWeight: 365.45206

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(NC1=O)C2=CC=C(C=C2)C3=NNC(=S)N3C4=CC=CC=C4)C

Isomeric SMILES

CC1(CN(NC1=O)C2=CC=C(C=C2)C3=NNC(=S)N3C4=CC=CC=C4)C

InChI

InChI=1S/C19H19N5OS/c1-19(2)12-23(22-17(19)25)14-10-8-13(9-11-14)16-20-21-18(26)24(16)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,21,26)(H,22,25)