Vitas-M small molecule compound

(10E)-10-(1H-indol-3-ylmethylidene)-7-(3-methoxyphenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one

Catalog ID
STK742961
SMILES COc1cccc(c1)C1C2=C(N=c3n1c(=O)/c(=C\c1c[nH]c4c1cccc4)/s3)c1c(CC2)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 C30H23N3O2S MW 489.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23N3O2S/c1-35-21-9-6-8-19(15-21)28-24-14-13-18-7-2-3-11-23(18)27(24)32-30-33(28)29(34)26(36-30)16-20-17-31-25-12-5-4-10-22(20)25/h2-12,15-17,28,31H,13-14H2,1H3/b26-16+
InChIKey
SMJJFRIWGHZOOI-WGOQTCKBSA-N
Synonyms

(10E)10(1Hindol3ylmethylidene)7(3methoxyphenyl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(Z)10((1Hindol3yl)methylene)7(3methoxyphenyl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
10(1HINDOL3YLMETHYLENE)7(3METHOXYPHENYL)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN9(10H)ONE
COC1=CC=CC(=C1)C2C3=C(C4=CC=CC=C4CC3)N=C5N2C(=O)C(=CC6=CNC7=CC=CC=C76)S5
COc1cccc(c1)C1C2=C(N=c3n1c(=O)c(=Cc1c(nH)c4c1cccc4)s3)c1c(CC2)cccc1
InChI=1SC30H23N3O2Sc1352196819(1521)28241413187231123(18)27(24)323033(28)29(34)26(3630)162017312512541022(20)25h21215172831H1314H21H3b2616+
MFCD02799031
ZINC000008438539
ZINC000008438542

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Available files

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