Vitas-M small molecule compound
(10Z)-10-[(1-butyl-1H-indol-3-yl)methylidene]-7-phenyl-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK186593
SMILES CCCCn1cc(c2c1cccc2)/C=c/1\sc2=NC3=C(C(n2c1=O)c1ccccc1)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 C33H29N3OS MW 515.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29N3OS/c1-2-3-19-35-21-24(25-14-9-10-16-28(25)35)20-29-32(37)36-31(23-12-5-4-6-13-23)27-18-17-22-11-7-8-15-26(22)30(27)34-33(36)38-29/h4-16,20-21,31H,2-3,17-19H2,1H3/b29-20-InChIKey
IKNHXBNTDVITDN-BRPDVVIDSA-NSynonyms
(10Z)10((1BUTYL1HINDOL3YL)METHYLIDENE)7PHENYL57DIHYDRO6HBENZO(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=C7
CCCCn1cc(c2c1cccc2)C=c1sc2=NC3=C(C(n2c1=O)c1ccccc1)CCc1c3cccc1
InChI=1SC33H29N3OSc12319352124(25149101628(25)35)202932(37)3631(23125461323)2718172211781526(22)30(27)3433(36)3829h416202131H231719H21H3b2920
MFCD06664535
ZINC000009907471
ZINC000009907472
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