Vitas-M small molecule compound
N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitro-4-(pyrrolidin-1-yl)benzamide
Catalog ID
STK327504
SMILES Cc1cc(C)c2c(c1)nc(o2)c1cccc(c1C)NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCCC1
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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 C27H26N4O4 MW 470.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O4/c1-16-13-17(2)25-22(14-16)29-27(35-25)20-7-6-8-21(18(20)3)28-26(32)19-9-10-23(24(15-19)31(33)34)30-11-4-5-12-30/h6-10,13-15H,4-5,11-12H2,1-3H3,(H,28,32)InChIKey
PULNUCSKMFHGHH-UHFFFAOYSA-NSynonyms
CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CC=C3)NC(=O)C4=CC(=C(C=C4)N5CCCC5)(N+)(=O)(O))C)C
Cc1cc(C)c2c(c1)nc(o2)c1cccc(c1C)NC(=O)c1ccc(c(c1)(N+)(=O)(O))N1CCCC1
InChI=1SC27H26N4O4c1161317(2)2522(1416)2927(3525)2076821(18(20)3)2826(32)1991023(24(1519)31(33)34)3011451230h6101315H451112H213H3(H2832)
MFCD03909980
N(3(57dimethyl13benzoxazol2yl)2methylphenyl)3nitro4(pyrrolidin1yl)benzamide
N(3(57DIMETHYL13BENZOXAZOL2YL)2METHYLPHENYL)3NITRO4PYRROLIDIN1YLBENZAMIDE
ZINC000018190646
ZINC18190646
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