Vitas-M small molecule compound

(10Z)-10-{[5-(4-acetylphenyl)furan-2-yl]methylidene}-7-(4-methoxyphenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one

Catalog ID
STL071476
SMILES COc1ccc(cc1)C1C2=C(N=c3n1c(=O)/c(=C/c1ccc(o1)c1ccc(cc1)C(=O)C)/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 C34H26N2O4S MW 558.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H26N2O4S/c1-20(37)21-7-9-23(10-8-21)29-18-16-26(40-29)19-30-33(38)36-32(24-11-14-25(39-2)15-12-24)28-17-13-22-5-3-4-6-27(22)31(28)35-34(36)41-30/h3-12,14-16,18-19,32H,13,17H2,1-2H3/b30-19-
InChIKey
MHZHTWSPPQMTSO-FSGOGVSDSA-N
Synonyms

(10Z)10((5(4acetylphenyl)furan2yl)methylidene)7(4methoxyphenyl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(Z)10((5(4acetylphenyl)furan2yl)methylene)7(4methoxyphenyl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C(=O)N4C(C5=C(C6=CC=CC=C6CC5)N=C4S3)C7=CC=C(C=C7)OC
COc1ccc(cc1)C1C2=C(N=c3n1c(=O)c(=Cc1ccc(o1)c1ccc(cc1)C(=O)C)s3)c1c(CC2)cccc1
InChI=1SC34H26N2O4Sc120(37)217923(10821)29181626(4029)193033(38)3632(24111425(392)151224)28171322534627(22)31(28)3534(36)4130h3121416181932H1317H212H3b3019
MFCD03679831
ZINC000001882737
ZINC000097968928

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Available files

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