Vitas-M small molecule compound

1-[(3,4-dichlorobenzyl)sulfanyl]-4-phenyl-7,8,9,10-tetrahydro-6H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one

Catalog ID
STK722378
SMILES Clc1ccc(cc1Cl)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCCC3

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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 C25H20Cl2N4OS2 MW 527.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20Cl2N4OS2/c26-18-12-11-15(13-19(18)27)14-33-25-29-28-24-30(16-7-3-1-4-8-16)22(32)21-17-9-5-2-6-10-20(17)34-23(21)31(24)25/h1,3-4,7-8,11-13H,2,5-6,9-10,14H2
InChIKey
FYCKHYPJIGSIAV-UHFFFAOYSA-N
Synonyms
351161-68-7
1((34dichlorobenzyl)sulfanyl)4phenyl78910tetrahydro6Hcyclohepta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((34dichlorobenzyl)thio)4phenyl78910tetrahydro4Hcyclohepta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(6H)one
351161687
C1CCC2=C(CC1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC(=C(C=C5)Cl)Cl)C6=CC=CC=C6
InChI=1SC25H20Cl2N4OS2c2618121115(1319(18)27)14332529282430(167314816)22(32)211795261020(17)3423(21)31(24)25h134781113H25691014H2
MFCD01878181
ZINC000002274038
ZINC2274038

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Available files

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