[4-[4-aminocarbonyl-5-methyl-1-(3-oxidanylpropyl)pyrrol-2-yl]-1,3-thiazol-2-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [4-[4-aminocarbonyl-5-methyl-1-(3-oxidanylpropyl)pyrrol-2-yl]-1,3-thiazol-2-yl]methyl 2,2-dimethylpropanoate Openeye Name: [4-[4-carbamoyl-1-(3-hydroxypropyl)-5-methyl-pyrrol-2-yl]thiazol-2-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[4-carbamoyl-1-(3-hydroxypropyl)-5-methyl-2-pyrrolyl]-2-thiazolyl]methyl ester IUPAC Name: [4-[4-carbamoyl-1-(3-hydroxypropyl)-5-methylpyrrol-2-yl]-1,3-thiazol-2-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[4-carbamoyl-1-(3-hydroxypropyl)-5-methyl-pyrrol-2-yl]thiazol-2-yl]methyl ester Formula: C18H25N3O4S MolecularWeight: 379.4738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CCCO)C2=CSC(=N2)COC(=O)C(C)(C)C)C(=O)N

Isomeric SMILES

CC1=C(C=C(N1CCCO)C2=CSC(=N2)COC(=O)C(C)(C)C)C(=O)N

InChI

InChI=1S/C18H25N3O4S/c1-11-12(16(19)23)8-14(21(11)6-5-7-22)13-10-26-15(20-13)9-25-17(24)18(2,3)4/h8,10,22H,5-7,9H2,1-4H3,(H2,19,23)