Vitas-M small molecule compound
(2E)-3-[4-(propan-2-yl)phenyl]-N-[(2-propyl-2H-tetrazol-5-yl)carbamothioyl]prop-2-enamide
Catalog ID
STK248330
SMILES CCCn1nnc(n1)NC(=S)NC(=O)/C=C/c1ccc(cc1)C(C)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 C17H22N6OS MW 358.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N6OS/c1-4-11-23-21-16(20-22-23)19-17(25)18-15(24)10-7-13-5-8-14(9-6-13)12(2)3/h5-10,12H,4,11H2,1-3H3,(H2,18,19,21,24,25)/b10-7+InChIKey
YFGLMQCRXAGKMU-JXMROGBWSA-NSynonyms
(2E)3(4(propan2yl)phenyl)N((2propyl2Htetrazol5yl)carbamothioyl)prop2enamide
(E)3(4PROPAN2YLPHENYL)N((2PROPYLTETRAZOL5YL)CARBAMOTHIOYL)PROP2ENAMIDE
CCCN1N=C(N=N1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)C(C)C
CCCn1nnc(n1)NC(=S)NC(=O)C=Cc1ccc(cc1)C(C)C
InChI=1SC17H22N6OSc1411232116(202223)1917(25)1815(24)107135814(9613)12(2)3h51012H411H213H3(H21819212425)b107+
MFCD03925907
ZINC000001267982
ZINC01267982
ZINC1267982
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