[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 2-imidazo[2,1-b][1,3]thiazol-6-ylethanoate

Systemtic Name: [2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 2-imidazo[2,1-b][1,3]thiazol-6-ylethanoate Openeye Name: [2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxo-ethyl] 2-imidazo[2,1-b]thiazol-6-ylacetate CAS Name: 2-(6-imidazo[2,1-b]thiazolyl)acetic acid [2-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethyl-1-phenethylpyrrol-3-yl)-2-oxoethyl] 2-imidazo[2,1-b][1,3]thiazol-6-ylacetate Traditional Name: 2-imidazo[2,1-b]thiazol-6-ylacetic acid [2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-keto-ethyl] ester Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)COC(=O)CC3=CN4C=CSC4=N3

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)COC(=O)CC3=CN4C=CSC4=N3

InChI

InChI=1S/C23H23N3O3S/c1-16-12-20(17(2)26(16)9-8-18-6-4-3-5-7-18)21(27)15-29-22(28)13-19-14-25-10-11-30-23(25)24-19/h3-7,10-12,14H,8-9,13,15H2,1-2H3