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

Systemtic Name: 2-[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]-N-(phenylmethyl)ethanamide Openeye Name: 2-[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]-N-benzyl-acetamide CAS Name: 2-[4-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-thiazolyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]-N-benzyl-acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H23N3OS/c1-4-10-24-15(2)11-18(16(24)3)19-14-26-21(23-19)12-20(25)22-13-17-8-6-5-7-9-17/h4-9,11,14H,1,10,12-13H2,2-3H3,(H,22,25)