N-(1,3-benzodioxol-5-yl)-2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)thio]propionamide Formula: C20H25N3O3S MolecularWeight: 387.4958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SC(C)C(=O)NC2=CC3=C(C=C2)OCO3)C4CCCC4)C

Isomeric SMILES

CC1=C(N(C(=N1)SC(C)C(=O)NC2=CC3=C(C=C2)OCO3)C4CCCC4)C

InChI

InChI=1S/C20H25N3O3S/c1-12-13(2)23(16-6-4-5-7-16)20(21-12)27-14(3)19(24)22-15-8-9-17-18(10-15)26-11-25-17/h8-10,14,16H,4-7,11H2,1-3H3,(H,22,24)