Vitas-M small molecule compound
(10Z)-10-[(1-butyl-1H-indol-3-yl)methylidene]-7-(naphthalen-1-yl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK322872
SMILES CCCCn1cc(c2c1cccc2)/C=c/1\sc2=NC3=C(C(n2c1=O)c1cccc2c1cccc2)CCc1c3cccc1
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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 C37H31N3OS MW 565.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H31N3OS/c1-2-3-21-39-23-26(28-15-8-9-18-32(28)39)22-33-36(41)40-35(30-17-10-13-24-11-4-6-14-27(24)30)31-20-19-25-12-5-7-16-29(25)34(31)38-37(40)42-33/h4-18,22-23,35H,2-3,19-21H2,1H3/b33-22-InChIKey
TYVGRFNMXBCLFS-NVMPUMLXSA-NSynonyms
(10Z)10((1butyl1Hindol3yl)methylidene)7(naphthalen1yl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
CCCCN1C=C(C2=CC=CC=C21)C=C3C(=O)N4C(C5=C(C6=CC=CC=C6CC5)N=C4S3)C7=CC=CC8=CC=CC=C87
CCCCn1cc(c2c1cccc2)C=c1sc2=NC3=C(C(n2c1=O)c1cccc2c1cccc2)CCc1c3cccc1
InChI=1SC37H31N3OSc12321392326(2815891832(28)39)223336(41)4035(301710132411461427(24)30)3120192512571629(25)34(31)3837(40)4233h418222335H231921H21H3b3322
MFCD09961632
ZINC000097962504
ZINC000097962505
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