Vitas-M small molecule compound
{4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}[4-(propan-2-yl)phenyl]methanone
Catalog ID
STK150282
SMILES [O-][N+](=O)c1ccc(cc1NCc1ccccc1)N1CCN(CC1)C(=O)c1ccc(cc1)C(C)C
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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 C27H30N4O3 MW 458.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O3/c1-20(2)22-8-10-23(11-9-22)27(32)30-16-14-29(15-17-30)24-12-13-26(31(33)34)25(18-24)28-19-21-6-4-3-5-7-21/h3-13,18,20,28H,14-17,19H2,1-2H3InChIKey
PXPUKDGWBQGKQR-UHFFFAOYSA-NSynonyms
(4(3(BENZYLAMINO)4NITROPHENYL)PIPERAZIN1YL)(4(PROPAN2YL)PHENYL)METHANONE
(4(3(BENZYLAMINO)4NITROPHENYL)PIPERAZIN1YL)(4PROPAN2YLPHENYL)METHANONE
(O)(N+)(=O)c1ccc(cc1NCc1ccccc1)N1CCN(CC1)C(=O)c1ccc(cc1)C(C)C
CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC4=CC=CC=C4
InChI=1SC27H30N4O3c120(2)2281023(11922)27(32)30161429(151730)24121326(31(33)34)25(1824)2819216435721h313182028H141719H212H3
MFCD03146793
ZINC000009720450
ZINC09720450
ZINC9720450
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