(E)-3-morpholin-4-ium-4-yl-N,N,2-triphenyl-prop-2-enethioamide

Systemtic Name: (E)-3-morpholin-4-ium-4-yl-N,N,2-triphenyl-prop-2-enethioamide Openeye Name: (E)-3-morpholin-4-ium-4-yl-N,N,2-triphenyl-prop-2-enethioamide CAS Name: (E)-3-(4-morpholin-4-iumyl)-N,N,2-triphenyl-2-propenethioamide IUPAC Name: (E)-3-morpholin-4-ium-4-yl-N,N,2-triphenylprop-2-enethioamide Traditional Name: (E)-3-morpholin-4-ium-4-yl-N,N,2-triphenyl-thioacrylamide Formula: C25H25N2OS+ MolecularWeight: 401.5438

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C=C(C2=CC=CC=C2)C(=S)N(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1/C=C(\C2=CC=CC=C2)/C(=S)N(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N2OS/c29-25(27(22-12-6-2-7-13-22)23-14-8-3-9-15-23)24(21-10-4-1-5-11-21)20-26-16-18-28-19-17-26/h1-15,20H,16-19H2/p+1/b24-20+