Vitas-M small molecule compound
{3,5-bis[(thiophen-2-ylmethyl)amino]-1H-1,2,4-triazol-1-yl}(2-nitrophenyl)methanone
Catalog ID
STK187674
SMILES O=C(c1ccccc1[N+](=O)[O-])n1nc(nc1NCc1cccs1)NCc1cccs1
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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 C19H16N6O3S2 MW 440.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N6O3S2/c26-17(15-7-1-2-8-16(15)25(27)28)24-19(21-12-14-6-4-10-30-14)22-18(23-24)20-11-13-5-3-9-29-13/h1-10H,11-12H2,(H2,20,21,22,23)InChIKey
NNZIERDOBKZZBG-UHFFFAOYSA-NSynonyms
767346-02-1(35BIS((THIOPHEN2YLMETHYL)AMINO)1H124TRIAZOL1YL)(2NITROPHENYL)METHANONE
(35BIS(THIOPHEN2YLMETHYLAMINO)124TRIAZOL1YL)(2NITROPHENYL)METHANONE
767346021
C1=CC=C(C(=C1)C(=O)N2C(=NC(=N2)NCC3=CC=CS3)NCC4=CC=CS4)(N+)(=O)(O)
InChI=1SC19H16N6O3S2c2617(15712816(15)25(27)28)2419(21121464103014)2218(2324)2011135392913h110H1112H2(H220212223)
MFCD06631184
O=C(c1ccccc1(N+)(=O)(O))n1nc(nc1NCc1cccs1)NCc1cccs1
ZINC000009129621
ZINC09129621
ZINC9129621
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