methyl 4-[[2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[2-(m-tolyl)thiazol-4-yl]acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[2-(3-methylphenyl)-4-thiazolyl]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[2-(m-tolyl)thiazol-4-yl]acetyl]amino]methyl]benzoic acid methyl ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=CS2)CC(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=CS2)CC(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H20N2O3S/c1-14-4-3-5-17(10-14)20-23-18(13-27-20)11-19(24)22-12-15-6-8-16(9-7-15)21(25)26-2/h3-10,13H,11-12H2,1-2H3,(H,22,24)