Vitas-M small molecule compound
2-methyl-3-phenyl-4-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
Catalog ID
STL311461
SMILES O=C(C1c2ccccc2C(=O)N(C1c1ccccc1)C)N1CCN(CC1)C/C=C/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 C30H31N3O2 MW 465.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N3O2/c1-31-28(24-14-6-3-7-15-24)27(25-16-8-9-17-26(25)29(31)34)30(35)33-21-19-32(20-22-33)18-10-13-23-11-4-2-5-12-23/h2-17,27-28H,18-22H2,1H3/b13-10+InChIKey
RQBJLHJFLJLWAV-JLHYYAGUSA-NSynonyms
1436016-21-5(E)4(4cinnamylpiperazine1carbonyl)2methyl3phenyl34dihydroisoquinolin1(2H)one
1436016215
2methyl3phenyl4((4((2E)3phenylprop2en1yl)piperazin1yl)carbonyl)34dihydroisoquinolin1(2H)one
2methyl3phenyl4(4((E)3phenylprop2enyl)piperazine1carbonyl)34dihydroisoquinolin1one
CN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)CC=CC4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC30H31N3O2c13128(24146371524)27(2516891726(25)29(31)34)30(35)33211932(202233)18101323114251223h2172728H1822H21H3b1310+
MFCD23138903
O=C(C1c2ccccc2C(=O)N(C1c1ccccc1)C)N1CCN(CC1)CC=Cc1ccccc1
ZINC000095474073
ZINC000095474076
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