Vitas-M small molecule compound
{5-[(1H-indol-5-ylmethyl)amino]-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl}(thiophen-2-yl)methanone
Catalog ID
STK659148
SMILES O=C(n1nc(nc1NCc1ccc2c(c1)cc[nH]2)c1cccnc1)c1cccs1
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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 C21H16N6OS MW 400.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N6OS/c28-20(18-4-2-10-29-18)27-21(25-19(26-27)16-3-1-8-22-13-16)24-12-14-5-6-17-15(11-14)7-9-23-17/h1-11,13,23H,12H2,(H,24,25,26)InChIKey
JLYLTKBDZDMRQT-UHFFFAOYSA-NSynonyms
1144463-32-0(5(((1Hindol5yl)methyl)amino)3(pyridin3yl)1H124triazol1yl)(thiophen2yl)methanone
(5((1Hindol5ylmethyl)amino)3(pyridin3yl)1H124triazol1yl)(thiophen2yl)methanone
(5(1Hindol5ylmethylamino)3pyridin3yl124triazol1yl)thiophen2ylmethanone
1144463320
C1=CC(=CN=C1)C2=NN(C(=N2)NCC3=CC4=C(C=C3)NC=C4)C(=O)C5=CC=CS5
InChI=1SC21H16N6OSc2820(1842102918)2721(2519(2627)16318221316)241214561715(1114)792317h1111323H12H2(H242526)
MFCD12211366
O=C(n1nc(nc1NCc1ccc2c(c1)cc(nH)2)c1cccnc1)c1cccs1
ZINC000032071900
ZINC32071900
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