Vitas-M small molecule compound
N-[(2Z)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-(7,8-dimethoxy-2-oxo-1,2-dihydro-3H-3-benzazepin-3-yl)acetamide
Catalog ID
STL309396
SMILES COc1cc2C=CN(C(=O)Cc2cc1OC)CC(=O)/N=c\1/[nH]nc(s1)C1CCCCC1
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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 C22H26N4O4S MW 442.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O4S/c1-29-17-10-15-8-9-26(20(28)12-16(15)11-18(17)30-2)13-19(27)23-22-25-24-21(31-22)14-6-4-3-5-7-14/h8-11,14H,3-7,12-13H2,1-2H3,(H,23,25,27)InChIKey
NTRZDFKJCZDXLQ-UHFFFAOYSA-NSynonyms
1574412-34-21574412342
COC1=C(C=C2C=CN(C(=O)CC2=C1)CC(=O)NC3=NN=C(S3)C4CCCCC4)OC
COc1cc2C=CN(C(=O)Cc2cc1OC)CC(=O)N=c1(nH)nc(s1)C1CCCCC1
InChI=1SC22H26N4O4Sc1291710158926(20(28)1216(15)1118(17)302)1319(27)2322252421(3122)146435714h81114H371213H212H3(H232527)
MFCD28028904
N((2Z)5cyclohexyl134thiadiazol2(3H)ylidene)2(78dimethoxy2oxo12dihydro3H3benzazepin3yl)acetamide
N(5cyclohexyl134thiadiazol2yl)2(78dimethoxy2oxo1H3benzazepin3yl)acetamide
ZINC000095472542
ZINC95472542
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