2-[5,6-dimethyl-2-(3-oxidanylpropylamino)benzimidazol-1-yl]-1-thiophen-2-yl-ethanone

Systemtic Name: 2-[5,6-dimethyl-2-(3-oxidanylpropylamino)benzimidazol-1-yl]-1-thiophen-2-yl-ethanone Openeye Name: 2-[2-(3-hydroxypropylamino)-5,6-dimethyl-benzimidazol-1-yl]-1-(2-thienyl)ethanone CAS Name: 2-[2-(3-hydroxypropylamino)-5,6-dimethyl-1-benzimidazolyl]-1-thiophen-2-ylethanone IUPAC Name: 2-[2-(3-hydroxypropylamino)-5,6-dimethylbenzimidazol-1-yl]-1-thiophen-2-ylethanone Traditional Name: 2-[2-(3-hydroxypropylamino)-5,6-dimethyl-benzimidazol-1-yl]-1-(2-thienyl)ethanone Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)NCCCO)CC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)NCCCO)CC(=O)C3=CC=CS3

InChI

InChI=1S/C18H21N3O2S/c1-12-9-14-15(10-13(12)2)21(18(20-14)19-6-4-7-22)11-16(23)17-5-3-8-24-17/h3,5,8-10,22H,4,6-7,11H2,1-2H3,(H,19,20)