Vitas-M small molecule compound
5-(1,3-benzoxazol-2-yl)-2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1H-isoindole-1,3(2H)-dione
Catalog ID
STK731662
SMILES O=C1c2cc(ccc2C(=O)N1c1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-])c1oc2c(n1)cccc2
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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 C27H15N3O5S MW 493.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H15N3O5S/c31-26-21-14-5-16(25-28-23-3-1-2-4-24(23)35-25)15-22(21)27(32)29(26)17-6-10-19(11-7-17)36-20-12-8-18(9-13-20)30(33)34/h1-15HInChIKey
VZPKSJVSMXZHKY-UHFFFAOYSA-NSynonyms
5(13benzoxazol2yl)2(4((4nitrophenyl)sulfanyl)phenyl)1Hisoindole13(2H)dione
5(13BENZOXAZOL2YL)2(4(4NITROPHENYL)SULFANYLPHENYL)ISOINDOLE13DIONE
C1=CC=C2C(=C1)N=C(O2)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC=C(C=C5)SC6=CC=C(C=C6)(N+)(=O)(O)
InChI=1SC27H15N3O5Sc31262114516(252823312424(23)3525)1522(21)27(32)29(26)1761019(11717)362012818(91320)30(33)34h115H
MFCD01003880
O=C1c2cc(ccc2C(=O)N1c1ccc(cc1)Sc1ccc(cc1)(N+)(=O)(O))c1oc2c(n1)cccc2
ZINC000012360438
ZINC12360438
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