3-[2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanylethanoylamino]-N-cyclopropyl-benzamide

Systemtic Name: 3-[2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanylethanoylamino]-N-cyclopropyl-benzamide Openeye Name: 3-[[2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanylacetyl]amino]-N-cyclopropyl-benzamide CAS Name: 3-[[2-[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]-1-oxoethyl]amino]-N-cyclopropylbenzamide IUPAC Name: 3-[[2-(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanylacetyl]amino]-N-cyclopropylbenzamide Traditional Name: 3-[[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(=C2)C(=O)NC3CC3)C4CCCC4)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)C4CCCC4)C

InChI

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