Vitas-M small molecule compound
(10Z)-10-[(1-butyl-1H-indol-3-yl)methylidene]-7-(2-methoxyphenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK186595
SMILES CCCCn1cc(c2c1cccc2)/C=c/1\sc2=NC3=C(C(n2c1=O)c1ccccc1OC)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 C34H31N3O2S MW 545.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31N3O2S/c1-3-4-19-36-21-23(24-12-7-9-15-28(24)36)20-30-33(38)37-32(26-14-8-10-16-29(26)39-2)27-18-17-22-11-5-6-13-25(22)31(27)35-34(37)40-30/h5-16,20-21,32H,3-4,17-19H2,1-2H3/b30-20-InChIKey
NONIOVMYMOKGCD-COEJQBHMSA-NSynonyms
(10Z)10((1BUTYL1HINDOL3YL)METHYLIDENE)7(2METHOXYPHENYL)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=CC=C7OC
CCCCn1cc(c2c1cccc2)C=c1sc2=NC3=C(C(n2c1=O)c1ccccc1OC)CCc1c3cccc1
InChI=1SC34H31N3O2Sc13419362123(2412791528(24)36)203033(38)3732(26148101629(26)392)2718172211561325(22)31(27)3534(37)4030h516202132H341719H212H3b3020
MFCD06102128
ZINC000097960803
ZINC000097960804
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