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

Systemtic Name: N-tert-butyl-2-[4-[[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]methyl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-[[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]methyl]piperazin-1-yl]-N-tert-butyl-acetamide CAS Name: N-tert-butyl-2-[4-[[4-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-thiazolyl]methyl]-1-piperazinyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[[4-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-1,3-thiazol-2-yl]methyl]piperazin-1-yl]acetamide Traditional Name: 2-[4-[[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]methyl]piperazino]-N-tert-butyl-acetamide Formula: C23H35N5OS MolecularWeight: 429.6219

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)CN3CCN(CC3)CC(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)CN3CCN(CC3)CC(=O)NC(C)(C)C

InChI

InChI=1S/C23H35N5OS/c1-7-8-28-17(2)13-19(18(28)3)20-16-30-22(24-20)15-27-11-9-26(10-12-27)14-21(29)25-23(4,5)6/h7,13,16H,1,8-12,14-15H2,2-6H3,(H,25,29)