6-[1-(morpholin-4-ium-4-ylmethyl)-4-phenyl-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[1-(morpholin-4-ium-4-ylmethyl)-4-phenyl-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[1-(morpholin-4-ium-4-ylmethyl)-4-phenyl-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[1-(4-morpholin-4-iumylmethyl)-4-phenyl-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[1-(morpholin-4-ium-4-ylmethyl)-4-phenyl-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[1-(morpholin-4-ium-4-ylmethyl)-4-phenyl-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C19H21N4O2S+ MolecularWeight: 369.46064

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CN2C(=S)N(C(=C3C=CC=CC3=O)N2)C4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CN2C(=S)N(C(=C3C=CC=CC3=O)N2)C4=CC=CC=C4

InChI

InChI=1S/C19H20N4O2S/c24-17-9-5-4-8-16(17)18-20-22(14-21-10-12-25-13-11-21)19(26)23(18)15-6-2-1-3-7-15/h1-9,20H,10-14H2/p+1