(3E)-5-(2-methoxyphenyl)-3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-N-phenyl-pyrazolidine-1-carbothioamide

Systemtic Name: (3E)-5-(2-methoxyphenyl)-3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-N-phenyl-pyrazolidine-1-carbothioamide Openeye Name: (3E)-5-(2-methoxyphenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-N-phenyl-pyrazolidine-1-carbothioamide CAS Name: (3E)-5-(2-methoxyphenyl)-3-(6-oxo-1-cyclohexa-2,4-dienylidene)-N-phenyl-1-pyrazolidinecarbothioamide IUPAC Name: (3E)-5-(2-methoxyphenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-N-phenylpyrazolidine-1-carbothioamide Traditional Name: (3E)-3-(6-ketocyclohexa-2,4-dien-1-ylidene)-5-(2-methoxyphenyl)-N-phenyl-pyrazolidine-1-carbothioamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2CC(=C3C=CC=CC3=O)NN2C(=S)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C2C/C(=C\3/C=CC=CC3=O)/NN2C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C23H21N3O2S/c1-28-22-14-8-6-12-18(22)20-15-19(17-11-5-7-13-21(17)27)25-26(20)23(29)24-16-9-3-2-4-10-16/h2-14,20,25H,15H2,1H3,(H,24,29)/b19-17+