1-(morpholin-4-ium-4-ylmethyl)-3-(phenylmethyl)imidazole-2-thione

Systemtic Name: 1-(morpholin-4-ium-4-ylmethyl)-3-(phenylmethyl)imidazole-2-thione Openeye Name: 1-benzyl-3-(morpholin-4-ium-4-ylmethyl)imidazole-2-thione CAS Name: 1-(4-morpholin-4-iumylmethyl)-3-(phenylmethyl)-2-imidazolethione IUPAC Name: 1-benzyl-3-(morpholin-4-ium-4-ylmethyl)imidazole-2-thione Traditional Name: 1-benzyl-3-(morpholin-4-ium-4-ylmethyl)-4-imidazoline-2-thione Formula: C15H20N3OS+ MolecularWeight: 290.4038

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CN2C=CN(C2=S)CC3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CN2C=CN(C2=S)CC3=CC=CC=C3

InChI

InChI=1S/C15H19N3OS/c20-15-17(12-14-4-2-1-3-5-14)6-7-18(15)13-16-8-10-19-11-9-16/h1-7H,8-13H2/p+1