Vitas-M small molecule compound
4-{2-[(2-chlorobenzyl)amino]-3,4-dioxocyclobut-1-en-1-yl}piperazine-1-carbaldehyde
Catalog ID
STL152374
SMILES O=CN1CCN(CC1)C1=C(C(=O)C1=O)NCc1ccccc1Cl
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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 C16H16ClN3O3 MW 333.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN3O3/c17-12-4-2-1-3-11(12)9-18-13-14(16(23)15(13)22)20-7-5-19(10-21)6-8-20/h1-4,10,18H,5-9H2InChIKey
QOPJEKXISYQUQL-UHFFFAOYSA-NSynonyms
1282125-39-61282125396
4(2((2chlorobenzyl)amino)34dioxocyclobut1en1yl)piperazine1carbaldehyde
4(2((2chlorophenyl)methylamino)34dioxocyclobuten1yl)piperazine1carbaldehyde
C1CN(CCN1C=O)C2=C(C(=O)C2=O)NCC3=CC=CC=C3Cl
InChI=1SC16H16ClN3O3c1712421311(12)9181314(16(23)15(13)22)207519(1021)6820h141018H59H2
MFCD18798612
ZINC000101697448
ZINC101697448
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