methyl 2-[[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]carbonylamino]-3-methyl-butanoate Openeye Name: methyl 2-[[4-[4-(3-bromophenyl)thiazol-2-yl]piperidine-1-carbonyl]amino]-3-methyl-butanoate CAS Name: 2-[[[4-[4-(3-bromophenyl)-2-thiazolyl]-1-piperidinyl]-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidine-1-carbonyl]amino]-3-methylbutanoate Traditional Name: 2-[[4-[4-(3-bromophenyl)thiazol-2-yl]piperidine-1-carbonyl]amino]-3-methyl-butyric acid methyl ester Formula: C21H26BrN3O3S MolecularWeight: 480.41844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)N1CCC(CC1)C2=NC(=CS2)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=O)N1CCC(CC1)C2=NC(=CS2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H26BrN3O3S/c1-13(2)18(20(26)28-3)24-21(27)25-9-7-14(8-10-25)19-23-17(12-29-19)15-5-4-6-16(22)11-15/h4-6,11-14,18H,7-10H2,1-3H3,(H,24,27)