Vitas-M small molecule compound
N-[(2Z)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Catalog ID
STK929966
SMILES O=C(c1noc2c1CCCCC2)/N=c\1/[nH]c2c(s1)cc(cc2)S(=O)(=O)C
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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 C17H17N3O4S2 MW 391.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O4S2/c1-26(22,23)10-7-8-12-14(9-10)25-17(18-12)19-16(21)15-11-5-3-2-4-6-13(11)24-20-15/h7-9H,2-6H2,1H3,(H,18,19,21)InChIKey
LXBYGJPBPOSVBQ-UHFFFAOYSA-NSynonyms
1190278-37-51190278375
CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NOC4=C3CCCCC4
InChI=1SC17H17N3O4S2c126(2223)10781214(910)2517(1812)1916(21)15115324613(11)242015h79H26H21H3(H181921)
MFCD18176509
N((2Z)6(methylsulfonyl)13benzothiazol2(3H)ylidene)5678tetrahydro4Hcyclohepta(d)(12)oxazole3carboxamide
N(6methylsulfonyl13benzothiazol2yl)5678tetrahydro4Hcyclohepta(d)(12)oxazole3carboxamide
O=C(c1noc2c1CCCCC2)N=c1(nH)c2c(s1)cc(cc2)S(=O)(=O)C
ZINC000036359138
ZINC36359138
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