Vitas-M small molecule compound
5-{[(4-methylphenyl)sulfonyl]amino}-N-(4-nitrophenyl)-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL439140
SMILES Cc1ccc(cc1)S(=O)(=O)Nc1[nH]nnc1C(=O)Nc1ccc(cc1)[N+](=O)[O-]
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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 C16H14N6O5S MW 402.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N6O5S/c1-10-2-8-13(9-3-10)28(26,27)20-15-14(18-21-19-15)16(23)17-11-4-6-12(7-5-11)22(24)25/h2-9H,1H3,(H,17,23)(H2,18,19,20,21)InChIKey
VHCBFEVFELWVBR-UHFFFAOYSA-NSynonyms
5(((4methylphenyl)sulfonyl)amino)N(4nitrophenyl)1H123triazole4carboxamide
5((4METHYLPHENYL)SULFONYLAMINO)N(4NITROPHENYL)2HTRIAZOLE4CARBOXAMIDE
CC1=CC=C(C=C1)S(=O)(=O)NC2=NNN=C2C(=O)NC3=CC=C(C=C3)(N+)(=O)(O)
Cc1ccc(cc1)S(=O)(=O)Nc1(nH)nnc1C(=O)Nc1ccc(cc1)(N+)(=O)(O)
InChI=1SC16H14N6O5Sc1102813(9310)28(2627)201514(18211915)16(23)17114612(7511)22(24)25h29H1H3(H1723)(H218192021)
MFCD06242854
ZINC000008694927
ZINC8694927
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