Vitas-M small molecule compound
2-[(3S)-2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide
Catalog ID
STK935797
SMILES CCCc1nnc(s1)NC(=O)C[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 C16H17N5O3S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5O3S/c1-2-5-13-20-21-16(25-13)19-12(22)8-11-15(24)17-10-7-4-3-6-9(10)14(23)18-11/h3-4,6-7,11H,2,5,8H2,1H3,(H,17,24)(H,18,23)(H,19,21,22)/t11-/m0/s1InChIKey
PBCNGGIYHTYVAJ-NSHDSACASA-NSynonyms
1246055-63-91246055639
2((3S)25dioxo34dihydro1H14benzodiazepin3yl)N(5propyl134thiadiazol2yl)acetamide
2((3S)2hydroxy5oxo45dihydro3H14benzodiazepin3yl)N(5propyl134thiadiazol2yl)acetamide
CCCC1=NN=C(S1)NC(=O)CC2C(=O)NC3=CC=CC=C3C(=O)N2
CCCc1nnc(s1)NC(=O)C(C@@H)1NC(=O)c2c(N=C1O)cccc2
InChI=1SC16H17N5O3Sc12513202116(2513)1912(22)81115(24)171074369(10)14(23)1811h346711H258H21H3(H1724)(H1823)(H192122)t11m0s1
MFCD18178158
ZINC000044901448
ZINC44901448
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