Vitas-M small molecule compound
3-[(3R)-2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl]-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]propanamide
Catalog ID
STK940658
SMILES COCc1nnc(s1)NC(=O)CC[C@H]1NC(=O)c2c(N=C1O)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 C16H17N5O4S MW 375.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5O4S/c1-25-8-13-20-21-16(26-13)19-12(22)7-6-11-15(24)17-10-5-3-2-4-9(10)14(23)18-11/h2-5,11H,6-8H2,1H3,(H,17,24)(H,18,23)(H,19,21,22)/t11-/m1/s1InChIKey
BGMBULKPSPZHFL-LLVKDONJSA-NSynonyms
1246071-47-51246071475
3((3R)25dioxo34dihydro1H14benzodiazepin3yl)N(5(methoxymethyl)134thiadiazol2yl)propanamide
3((3R)2hydroxy5oxo45dihydro3H14benzodiazepin3yl)N(5(methoxymethyl)134thiadiazol2yl)propanamide
COCC1=NN=C(S1)NC(=O)CCC2C(=O)NC3=CC=CC=C3C(=O)N2
COCc1nnc(s1)NC(=O)CC(C@H)1NC(=O)c2c(N=C1O)cccc2
InChI=1SC16H17N5O4Sc125813202116(2613)1912(22)761115(24)171053249(10)14(23)1811h2511H68H21H3(H1724)(H1823)(H192122)t11m1s1
MFCD18179592
ZINC000044919267
ZINC44919267
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