Vitas-M small molecule compound
N-[(3-oxo-3,5,7,8-tetrahydro-2H-thiopyrano[4,3-c]pyridazin-2-yl)acetyl]phenylalanine
Catalog ID
STL152995
SMILES O=C(Cn1nc2CCSCc2cc1=O)NC(C(=O)O)Cc1ccccc1
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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 C18H19N3O4S MW 373.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O4S/c22-16(19-15(18(24)25)8-12-4-2-1-3-5-12)10-21-17(23)9-13-11-26-7-6-14(13)20-21/h1-5,9,15H,6-8,10-11H2,(H,19,22)(H,24,25)InChIKey
ZEUIMDPEWCJBIP-UHFFFAOYSA-NSynonyms
(S)2(2(3oxo3578tetrahydro2Hthiopyrano(43c)pyridazin2yl)acetamido)3phenylpropanoicacid
2((2(3oxo78dihydro5Hthiopyrano(43c)pyridazin2yl)acetyl)amino)3phenylpropanoicacid
C1CSCC2=CC(=O)N(N=C21)CC(=O)NC(CC3=CC=CC=C3)C(=O)O
InChI=1SC18H19N3O4Sc2216(1915(18(24)25)8124213512)102117(23)91311267614(13)2021h15915H681011H2(H1922)(H2425)
MFCD20756541
N((3oxo3578tetrahydro2Hthiopyrano(43c)pyridazin2yl)acetyl)phenylalanine
O=C(Cn1nc2CCSCc2cc1=O)N(C@H)(C(=O)O)Cc1ccccc1
ZINC000071280162
ZINC000071328838
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