ethyl 2-[2-[[6-(3-bromophenyl)-2-methyl-pyridin-3-yl]carbonylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[[6-(3-bromophenyl)-2-methyl-pyridin-3-yl]carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[6-(3-bromophenyl)-2-methyl-pyridine-3-carbonyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[[6-(3-bromophenyl)-2-methyl-3-pyridinyl]-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[6-(3-bromophenyl)-2-methylpyridine-3-carbonyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[6-(3-bromophenyl)-2-methyl-nicotinoyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C20H18BrN3O3S MolecularWeight: 460.34422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=C(N=C(C=C2)C3=CC(=CC=C3)Br)C

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=C(N=C(C=C2)C3=CC(=CC=C3)Br)C

InChI

InChI=1S/C20H18BrN3O3S/c1-3-27-18(25)10-15-11-28-20(23-15)24-19(26)16-7-8-17(22-12(16)2)13-5-4-6-14(21)9-13/h4-9,11H,3,10H2,1-2H3,(H,23,24,26)