Vitas-M small molecule compound
methyl N-{3-[(3S)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]propanoyl}-beta-alaninate
Catalog ID
STL535935
SMILES COC(=O)CCNC(=O)CC[C@@H]1NC(=O)c2c(NC1=O)cccc2
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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 C16H19N3O5 MW 333.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O5/c1-24-14(21)8-9-17-13(20)7-6-12-16(23)18-11-5-3-2-4-10(11)15(22)19-12/h2-5,12H,6-9H2,1H3,(H,17,20)(H,18,23)(H,19,22)/t12-/m0/s1InChIKey
SUWFYIYXAYEECF-LBPRGKRZSA-NSynonyms
1212121-11-3(S)methyl3(3(25dioxo2345tetrahydro1Hbenzo(e)(14)diazepin3yl)propanamido)propanoate
1212121113
45490588
COC(=O)CCNC(=O)CC(C@@H)1NC(=O)c2c(NC1=O)cccc2
InChI=1SC16H19N3O5c12414(21)891713(20)761216(23)1811532410(11)15(22)1912h2512H69H21H3(H1720)(H1823)(H1922)t12m0s1
methyl3(3((3~(S))25dioxo34dihydro1~(H)14benzodiazepin3yl)propanoylamino)propanoate
methylN(3((3S)25dioxo2345tetrahydro1H14benzodiazepin3yl)propanoyl)betaalaninate
ZINC000036369949
ZINC36369949
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