ethyl 2-methyl-5-(4-methylphenyl)-1-[3-oxidanylidene-3-(1,3-thiazol-2-ylamino)propyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-(4-methylphenyl)-1-[3-oxidanylidene-3-(1,3-thiazol-2-ylamino)propyl]pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-1-[3-oxo-3-(thiazol-2-ylamino)propyl]-5-(p-tolyl)pyrrole-3-carboxylate CAS Name: 2-methyl-5-(4-methylphenyl)-1-[3-oxo-3-(2-thiazolylamino)propyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-(4-methylphenyl)-1-[3-oxo-3-(1,3-thiazol-2-ylamino)propyl]pyrrole-3-carboxylate Traditional Name: 1-[3-keto-3-(thiazol-2-ylamino)propyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylic acid ethyl ester Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)C)CCC(=O)NC3=NC=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)C)CCC(=O)NC3=NC=CS3)C

InChI

InChI=1S/C21H23N3O3S/c1-4-27-20(26)17-13-18(16-7-5-14(2)6-8-16)24(15(17)3)11-9-19(25)23-21-22-10-12-28-21/h5-8,10,12-13H,4,9,11H2,1-3H3,(H,22,23,25)