Vitas-M small molecule compound

N~1~-[(E)-(4-tert-butylphenyl)methylidene]-3-(phenylsulfonyl)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine

Catalog ID
STK920943
SMILES Nc1n(/N=C/c2ccc(cc2)C(C)(C)C)c2c(c1S(=O)(=O)c1ccccc1)nc1c(n2)cccc1

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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 C27H25N5O2S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2S/c1-27(2,3)19-15-13-18(14-16-19)17-29-32-25(28)24(35(33,34)20-9-5-4-6-10-20)23-26(32)31-22-12-8-7-11-21(22)30-23/h4-17H,28H2,1-3H3/b29-17+
InChIKey
GYZWVGSYMZSBCV-STBIYBPSSA-N
Synonyms
843630-96-6
(E)N1(4(tertbutyl)benzylidene)3(phenylsulfonyl)1Hpyrrolo(23b)quinoxaline12diamine
3(benzenesulfonyl)1((E)(4tertbutylphenyl)methylideneamino)pyrrolo(32b)quinoxalin2amine
843630966
CC(C)(C)C1=CC=C(C=C1)C=NN2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=CC=C5)N
InChI=1SC27H25N5O2Sc127(23)19151318(141619)17293225(28)24(35(3334)2095461020)2326(32)312212871121(22)3023h417H28H213H3b2917+
MFCD04016940
N~1~((E)(4tertbutylphenyl)methylidene)3(phenylsulfonyl)1Hpyrrolo(23b)quinoxaline12diamine
N1((E)(4TERTBUTYLPHENYL)METHYLIDENE)3(PHENYLSULFONYL)1HPYRROLO(23B)QUINOXALINE12DIAMINE
Nc1n(N=Cc2ccc(cc2)C(C)(C)C)c2c(c1S(=O)(=O)c1ccccc1)nc1c(n2)cccc1
ZINC000008818487
ZINC33403628

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Available files

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