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

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]ethanamide Openeye Name: N-[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]-2-(4-chloro-3-methyl-phenoxy)acetamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-[4-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-thiazolyl]acetamide IUPAC Name: 2-(4-chloro-3-methylphenoxy)-N-[4-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-1,3-thiazol-2-yl]acetamide Traditional Name: N-[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]-2-(4-chloro-3-methyl-phenoxy)acetamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)NC(=O)COC3=CC(=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)NC(=O)COC3=CC(=C(C=C3)Cl)C

InChI

InChI=1S/C21H22ClN3O2S/c1-5-8-25-14(3)10-17(15(25)4)19-12-28-21(23-19)24-20(26)11-27-16-6-7-18(22)13(2)9-16/h5-7,9-10,12H,1,8,11H2,2-4H3,(H,23,24,26)