Vitas-M small molecule compound

N,2-bis{4-[(4-nitrophenyl)sulfanyl]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide

Catalog ID
STK156667
SMILES O=C(c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-])Nc1ccc(cc1)Sc1ccc(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 C33H20N4O7S2 MW 648.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H20N4O7S2/c38-31(34-21-2-10-25(11-3-21)45-27-14-6-23(7-15-27)36(41)42)20-1-18-29-30(19-20)33(40)35(32(29)39)22-4-12-26(13-5-22)46-28-16-8-24(9-17-28)37(43)44/h1-19H,(H,34,38)
InChIKey
IJPFGKAHBDVQQU-UHFFFAOYSA-N
Synonyms

C1=CC(=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)SC5=CC=C(C=C5)(N+)(=O)(O))SC6=CC=C(C=C6)(N+)(=O)(O)
InChI=1SC33H20N4O7S2c3831(342121025(11321)452714623(71527)36(41)42)201182930(1920)33(40)35(32(29)39)2241226(13522)462816824(91728)37(43)44h119H(H3438)
MFCD00304211
N2BIS(4((4NITROPHENYL)SULFANYL)PHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXAMIDE
N2BIS(4(4NITROPHENYL)SULFANYLPHENYL)13DIOXOISOINDOLE5CARBOXAMIDE
O=C(c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)Sc1ccc(cc1)(N+)(=O)(O))Nc1ccc(cc1)Sc1ccc(cc1)(N+)(=O)(O)
ZINC000150410974
ZINC150410974

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.