Vitas-M small molecule compound
N-[(4-methyl-5-{[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]furan-2-carboxamide
Catalog ID
STK497528
SMILES Cn1c(SCC(=O)c2cccc(c2)[N+](=O)[O-])nnc1CNC(=O)c1ccco1
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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 C17H15N5O5S MW 401.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N5O5S/c1-21-15(9-18-16(24)14-6-3-7-27-14)19-20-17(21)28-10-13(23)11-4-2-5-12(8-11)22(25)26/h2-8H,9-10H2,1H3,(H,18,24)InChIKey
JTYQTIIBXVJMRL-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)C2=CC(=CC=C2)(N+)(=O)(O))CNC(=O)C3=CC=CO3
Cn1c(SCC(=O)c2cccc(c2)(N+)(=O)(O))nnc1CNC(=O)c1ccco1
InChI=1SC17H15N5O5Sc12115(91816(24)146372714)192017(21)281013(23)1142512(811)22(25)26h28H910H21H3(H1824)
MFCD11854916
N((4methyl5((2(3nitrophenyl)2oxoethyl)sulfanyl)4H124triazol3yl)methyl)furan2carboxamide
N((4METHYL5(2(3NITROPHENYL)2OXOETHYL)SULFANYL124TRIAZOL3YL)METHYL)FURAN2CARBOXAMIDE
ZINC000032579257
ZINC32579257
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