N-tert-butyl-2-[4-[[4-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-1,3-thiazol-2-yl]methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[[4-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-1,3-thiazol-2-yl]methyl]piperazin-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[[4-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]methyl]piperazin-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[[4-(1-ethyl-2,5-dimethyl-3-pyrrolyl)-2-thiazolyl]methyl]-1-piperazinyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[[4-(1-ethyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-yl]methyl]piperazin-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[[4-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]methyl]piperazino]acetamide Formula: C22H35N5OS MolecularWeight: 417.6112

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C2=CSC(=N2)CN3CCN(CC3)CC(=O)NC(C)(C)C)C

Isomeric SMILES

CCN1C(=CC(=C1C)C2=CSC(=N2)CN3CCN(CC3)CC(=O)NC(C)(C)C)C

InChI

InChI=1S/C22H35N5OS/c1-7-27-16(2)12-18(17(27)3)19-15-29-21(23-19)14-26-10-8-25(9-11-26)13-20(28)24-22(4,5)6/h12,15H,7-11,13-14H2,1-6H3,(H,24,28)