Vitas-M small molecule compound

2-[(3S)-2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide

Catalog ID
STK935455
SMILES O=C(C[C@@H]1NC(=O)c2c(N=C1O)cccc2)Nc1nc2c(s1)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 C18H18N4O3S MW 370.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O3S/c23-15(22-18-21-12-7-3-4-8-14(12)26-18)9-13-17(25)19-11-6-2-1-5-10(11)16(24)20-13/h1-2,5-6,13H,3-4,7-9H2,(H,19,25)(H,20,24)(H,21,22,23)/t13-/m0/s1
InChIKey
HXZSFLOBJKCPND-ZDUSSCGKSA-N
Synonyms
1246071-64-6
1246071646
2((3S)25dioxo34dihydro1H14benzodiazepin3yl)N(4567tetrahydro13benzothiazol2yl)acetamide
2((3S)2hydroxy5oxo45dihydro3H14benzodiazepin3yl)N(4567tetrahydro13benzothiazol2yl)acetamide
C1CCC2=C(C1)N=C(S2)NC(=O)CC3C(=O)NC4=CC=CC=C4C(=O)N3
InChI=1SC18H18N4O3Sc2315(22182112734814(12)2618)91317(25)1911621510(11)16(24)2013h125613H3479H2(H1925)(H2024)(H212223)t13m0s1
MFCD18178071
O=C(C(C@@H)1NC(=O)c2c(N=C1O)cccc2)Nc1nc2c(s1)CCCC2
ZINC000044901241
ZINC44901241

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Available files

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