2-[4-[2-(1-cyclopropylimidazol-2-yl)sulfanylethanoyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-[2-(1-cyclopropylimidazol-2-yl)sulfanylethanoyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[4-[2-(1-cyclopropylimidazol-2-yl)sulfanylacetyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[4-[2-[(1-cyclopropyl-2-imidazolyl)thio]-1-oxoethyl]-1-piperazinyl]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[4-[2-(1-cyclopropylimidazol-2-yl)sulfanylacetyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[4-[2-[(1-cyclopropylimidazol-2-yl)thio]acetyl]piperazino]-N-(2,6-dimethylphenyl)acetamide Formula: C22H29N5O2S MolecularWeight: 427.56296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)CSC3=NC=CN3C4CC4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)CSC3=NC=CN3C4CC4

InChI

InChI=1S/C22H29N5O2S/c1-16-4-3-5-17(2)21(16)24-19(28)14-25-10-12-26(13-11-25)20(29)15-30-22-23-8-9-27(22)18-6-7-18/h3-5,8-9,18H,6-7,10-15H2,1-2H3,(H,24,28)