Vitas-M small molecule compound

methyl N-{[4-(1,3-benzothiazol-2-yl)phenyl]carbamoyl}-L-alaninate

Catalog ID
STK588549
SMILES COC(=O)[C@@H](NC(=O)Nc1ccc(cc1)c1nc2c(s1)cccc2)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C18H17N3O3S MW 355.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O3S/c1-11(17(22)24-2)19-18(23)20-13-9-7-12(8-10-13)16-21-14-5-3-4-6-15(14)25-16/h3-11H,1-2H3,(H2,19,20,23)/t11-/m0/s1
InChIKey
CCGQLMLFUMLXAA-NSHDSACASA-N
Synonyms
1173682-29-5
(S)methyl2(3(4(benzo(d)thiazol2yl)phenyl)ureido)propanoate
1173682295
CC(C(=O)OC)NC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2
COC(=O)(C@@H)(NC(=O)Nc1ccc(cc1)c1nc2c(s1)cccc2)C
InChI=1SC18H17N3O3Sc111(17(22)242)1918(23)20139712(81013)162114534615(14)2516h311H12H3(H2192023)t11m0s1
METHYL(2S)2((4(13BENZOTHIAZOL2YL)PHENYL)CARBAMOYLAMINO)PROPANOATE
methylN((4(13benzothiazol2yl)phenyl)carbamoyl)Lalaninate
MFCD06774786
ZINC000005246131
ZINC05246131
ZINC5246131

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.