Vitas-M small molecule compound

2-{(2E)-2-[5-chloro-2-(naphthalen-1-ylmethoxy)benzylidene]hydrazinyl}-4,6-di(pyrrolidin-1-yl)-1,3,5-triazine

Catalog ID
STK068417
SMILES Clc1ccc(c(c1)/C=N/Nc1nc(nc(n1)N1CCCC1)N1CCCC1)OCc1cccc2c1cccc2

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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 C29H30ClN7O MW 528.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30ClN7O/c30-24-12-13-26(38-20-22-10-7-9-21-8-1-2-11-25(21)22)23(18-24)19-31-35-27-32-28(36-14-3-4-15-36)34-29(33-27)37-16-5-6-17-37/h1-2,7-13,18-19H,3-6,14-17,20H2,(H,32,33,34,35)/b31-19+
InChIKey
PUVOUVIFJAIBRT-ZCTHSVRISA-N
Synonyms

2((2E)2(5CHLORO2(NAPHTHALEN1YLMETHOXY)BENZYLIDENE)HYDRAZINYL)46DI(PYRROLIDIN1YL)135TRIAZINE
5CHLORO2(1NAPHTHYLMETHOXY)BENZALDEHYDE(46DIPYRROLIDIN1YL135TRIAZIN2YL)HYDRAZONE
C1CCN(C1)C2=NC(=NC(=N2)NN=CC3=C(C=CC(=C3)Cl)OCC4=CC=CC5=CC=CC=C54)N6CCCC6
Clc1ccc(c(c1)C=NNc1nc(nc(n1)N1CCCC1)N1CCCC1)OCc1cccc2c1cccc2
InChI=1SC29H30ClN7Oc3024121326(3820221079218121125(21)22)23(1824)193135273228(3614341536)3429(3327)3716561737h127131819H36141720H2(H32333435)b3119+
MFCD02950926
N((E)(5chloro2(naphthalen1ylmethoxy)phenyl)methylideneamino)46dipyrrolidin1yl135triazin2amine
STK068417
ZINC000008492734
ZINC34828029

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.