Vitas-M small molecule compound
N-[(2E)-5-cyclopropyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide
Catalog ID
STL152532
SMILES O=C(Cn1nc2CCCCCc2cc1=O)/N=c/1\[nH]nc(s1)C1CC1
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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 C16H19N5O2S MW 345.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N5O2S/c22-13(17-16-19-18-15(24-16)10-6-7-10)9-21-14(23)8-11-4-2-1-3-5-12(11)20-21/h8,10H,1-7,9H2,(H,17,19,22)InChIKey
RNMGNGBNUYRJSI-UHFFFAOYSA-NSynonyms
1282132-41-51282132415
C1CCC2=CC(=O)N(N=C2CC1)CC(=O)NC3=NN=C(S3)C4CC4
InChI=1SC16H19N5O2Sc2213(1716191815(2416)106710)92114(23)8114213512(11)2021h810H179H2(H171922)
MFCD20756383
N((2E)5cyclopropyl134thiadiazol2(3H)ylidene)2(3oxo356789hexahydro2Hcyclohepta(c)pyridazin2yl)acetamide
N(5cyclopropyl134thiadiazol2yl)2(3oxo6789tetrahydro5Hcyclohepta(c)pyridazin2yl)acetamide
O=C(Cn1nc2CCCCCc2cc1=O)N=c1(nH)nc(s1)C1CC1
ZINC000061720760
ZINC61720760
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