Vitas-M small molecule compound

1-(8-chloro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-2-phenyl-2-(1H-tetrazol-1-yl)ethanone

Catalog ID
STL245317
SMILES Clc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)C(n1cnnn1)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 C20H17ClN6O MW 392.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN6O/c21-14-6-7-17-15(10-14)16-11-26(9-8-18(16)23-17)20(28)19(27-12-22-24-25-27)13-4-2-1-3-5-13/h1-7,10,12,19,23H,8-9,11H2
InChIKey
PPSJSUGVAQKYGD-UHFFFAOYSA-N
Synonyms

(S)1(8chloro34dihydro1Hpyrido(43b)indol2(5H)yl)2phenyl2(1Htetrazol1yl)ethanone
1(8chloro1345tetrahydro2Hpyrido(43b)indol2yl)2phenyl2(1Htetrazol1yl)ethanone
1(8chloro1345tetrahydropyrido(43b)indol2yl)2phenyl2(tetrazol1yl)ethanone
C1CN(CC2=C1NC3=C2C=C(C=C3)Cl)C(=O)C(C4=CC=CC=C4)N5C=NN=N5
Clc1ccc2c(c1)c1CN(CCc1(nH)2)C(=O)(C@@H)(n1cnnn1)c1ccccc1
Clc1ccc2c(c1)c1CN(CCc1(nH)2)C(=O)C(n1cnnn1)c1ccccc1
InChI=1SC20H17ClN6Oc2114671715(1014)161126(9818(16)2317)20(28)19(271222242527)134213513h1710121923H8911H2
MFCD24860222
ZINC000072402600
ZINC000080329079

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Available files

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