5-azanyl-2-ethyl-2-methoxy-3-(phenylmethyl)imidazole-4-thione

Systemtic Name: 5-azanyl-2-ethyl-2-methoxy-3-(phenylmethyl)imidazole-4-thione Openeye Name: 5-amino-3-benzyl-2-ethyl-2-methoxy-imidazole-4-thione CAS Name: 5-amino-2-ethyl-2-methoxy-3-(phenylmethyl)-4-imidazolethione IUPAC Name: 5-amino-3-benzyl-2-ethyl-2-methoxyimidazole-4-thione Traditional Name: 5-amino-3-benzyl-2-ethyl-2-methoxy-3-imidazoline-4-thione Formula: C13H17N3OS MolecularWeight: 263.35858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(N=C(C(=S)N1CC2=CC=CC=C2)N)OC

Isomeric SMILES

CCC1(N=C(C(=S)N1CC2=CC=CC=C2)N)OC

InChI

InChI=1S/C13H17N3OS/c1-3-13(17-2)15-11(14)12(18)16(13)9-10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3,(H2,14,15)