2-[2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanylethanoylamino]-N-cyclopropyl-benzamide

Systemtic Name: 2-[2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanylethanoylamino]-N-cyclopropyl-benzamide Openeye Name: 2-[[2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanylacetyl]amino]-N-cyclopropyl-benzamide CAS Name: 2-[[2-[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]-1-oxoethyl]amino]-N-cyclopropylbenzamide IUPAC Name: 2-[[2-(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanylacetyl]amino]-N-cyclopropylbenzamide Traditional Name: 2-[[2-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)thio]acetyl]amino]-N-cyclopropyl-benzamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)NC2=CC=CC=C2C(=O)NC3CC3)C4CCCC4)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)NC2=CC=CC=C2C(=O)NC3CC3)C4CCCC4)C

InChI

InChI=1S/C22H28N4O2S/c1-14-15(2)26(17-7-3-4-8-17)22(23-14)29-13-20(27)25-19-10-6-5-9-18(19)21(28)24-16-11-12-16/h5-6,9-10,16-17H,3-4,7-8,11-13H2,1-2H3,(H,24,28)(H,25,27)