Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-{3-[(E)-(2-carbamothioylhydrazinylidene)methyl]-1H-indol-1-yl}acetamide
Catalog ID
STL380587
SMILES O=C(Cn1cc(c2c1cccc2)/C=N/NC(=S)N)Nc1ccc2c(c1)OCO2
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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 C19H17N5O3S MW 395.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O3S/c20-19(28)23-21-8-12-9-24(15-4-2-1-3-14(12)15)10-18(25)22-13-5-6-16-17(7-13)27-11-26-16/h1-9H,10-11H2,(H,22,25)(H3,20,23,28)/b21-8+InChIKey
BQYSURBFSOSCHY-ODCIPOBUSA-NSynonyms
C1OC2=C(O1)C=C(C=C2)NC(=O)CN3C=C(C4=CC=CC=C43)C=NNC(=S)N
InChI=1SC19H17N5O3Sc2019(28)2321812924(15421314(12)15)1018(25)2213561617(713)27112616h19H1011H2(H2225)(H3202328)b218+
MFCD04277813
N(13benzodioxol5yl)2(3((E)(2carbamothioylhydrazinylidene)methyl)1Hindol1yl)acetamide
N(13benzodioxol5yl)2(3((E)(carbamothioylhydrazinylidene)methyl)indol1yl)acetamide
O=C(Cn1cc(c2c1cccc2)C=NNC(=S)N)Nc1ccc2c(c1)OCO2
ZINC000003643062
ZINC33249068
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