methyl 2,4-dimethyl-5-[5-methyl-2-[(phenylmethyl)amino]-1,3-thiazol-4-yl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[5-methyl-2-[(phenylmethyl)amino]-1,3-thiazol-4-yl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-(benzylamino)-5-methyl-thiazol-4-yl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[5-methyl-2-[(phenylmethyl)amino]-4-thiazolyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-(benzylamino)-5-methyl-1,3-thiazol-4-yl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(benzylamino)-5-methyl-thiazol-4-yl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C2=C(SC(=N2)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C2=C(SC(=N2)NCC3=CC=CC=C3)C

InChI

InChI=1S/C19H21N3O2S/c1-11-15(18(23)24-4)12(2)21-16(11)17-13(3)25-19(22-17)20-10-14-8-6-5-7-9-14/h5-9,21H,10H2,1-4H3,(H,20,22)