Vitas-M small molecule compound
N~2~-benzyl-N~2~-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}-N-(4-methoxyphenyl)-2-methylalaninamide
Catalog ID
STL446922
SMILES COc1ccc(cc1)NC(=O)C(N(C(=O)CSc1nc(C)cc(n1)C)Cc1ccccc1)(C)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 C26H30N4O3S MW 478.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O3S/c1-18-15-19(2)28-25(27-18)34-17-23(31)30(16-20-9-7-6-8-10-20)26(3,4)24(32)29-21-11-13-22(33-5)14-12-21/h6-15H,16-17H2,1-5H3,(H,29,32)InChIKey
GESXCGTVULHBFF-UHFFFAOYSA-NSynonyms
2(BENZYL(2((46DIMETHYL2PYRIMIDINYL)SULFANYL)ACETYL)AMINO)N(4METHOXYPHENYL)2METHYLPROPANAMIDE
2(BENZYL(2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)AMINO)N(4METHOXYPHENYL)2METHYLPROPANAMIDE
CC1=CC(=NC(=N1)SCC(=O)N(CC2=CC=CC=C2)C(C)(C)C(=O)NC3=CC=C(C=C3)OC)C
InChI=1SC26H30N4O3Sc1181519(2)2825(2718)341723(31)30(162097681020)26(34)24(32)2921111322(335)141221h615H1617H215H3(H2932)
MFCD06243541
N~2~benzylN~2~(((46dimethylpyrimidin2yl)sulfanyl)acetyl)N(4methoxyphenyl)2methylalaninamide
N2BENZYLN2(((46DIMETHYLPYRIMIDIN2YL)SULFANYL)ACETYL)N(4METHOXYPHENYL)2METHYLALANINAMIDE
ZINC000001407226
ZINC1407226
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