Vitas-M small molecule compound
N-{(2E)-3-(3-nitrophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}-beta-alanine
Catalog ID
STK527493
SMILES OC(=O)CCNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1
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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 C19H17N3O6 MW 383.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O6/c23-17(24)9-10-20-19(26)16(21-18(25)14-6-2-1-3-7-14)12-13-5-4-8-15(11-13)22(27)28/h1-8,11-12H,9-10H2,(H,20,26)(H,21,25)(H,23,24)/b16-12+InChIKey
KWDJFMIOFXCMQX-FOWTUZBSSA-NSynonyms
1799844-94-2(E)3(2benzamido3(3nitrophenyl)acrylamido)propanoicacid
1799844942
3(((E)2BENZAMIDO3(3NITROPHENYL)PROP2ENOYL)AMINO)PROPANOICACID
3((2E)3(3NITROPHENYL)2(PHENYLCARBONYLAMINO)PROP2ENOYLAMINO)PROPANOICACID
3(2BENZOYLAMINO3(3NITROPHENYL)ACRYLOYLAMINO)PROPIONICACID
C1=CC=C(C=C1)C(=O)NC(=CC2=CC(=CC=C2)(N+)(=O)(O))C(=O)NCCC(=O)O
InChI=1SC19H17N3O6c2317(24)9102019(26)16(2118(25)146213714)121354815(1113)22(27)28h181112H910H2(H2026)(H2125)(H2324)b1612+
MFCD00699044
N((2E)3(3nitrophenyl)2((phenylcarbonyl)amino)prop2enoyl)betaalanine
OC(=O)CCNC(=O)C(=Cc1cccc(c1)(N+)(=O)(O))NC(=O)c1ccccc1
ZINC000002250344
ZINC2250344
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