Vitas-M small molecule compound
(10Z)-7-(4-methoxyphenyl)-10-{[2-methyl-1-(prop-2-en-1-yl)-1H-indol-3-yl]methylidene}-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STL382319
SMILES C=CCn1c(C)c(c2c1cccc2)/C=c/1\sc2=NC3=C(C(n2c1=O)c1ccc(cc1)OC)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 C34H29N3O2S MW 543.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H29N3O2S/c1-4-19-36-21(2)28(26-11-7-8-12-29(26)36)20-30-33(38)37-32(23-13-16-24(39-3)17-14-23)27-18-15-22-9-5-6-10-25(22)31(27)35-34(37)40-30/h4-14,16-17,20,32H,1,15,18-19H2,2-3H3/b30-20-InChIKey
CMKUHBRNXIXMHI-COEJQBHMSA-NSynonyms
(10Z)7(4methoxyphenyl)10((2methyl1(prop2en1yl)1Hindol3yl)methylidene)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
C=CCn1c(C)c(c2c1cccc2)C=c1sc2=NC3=C(C(n2c1=O)c1ccc(cc1)OC)CCc1c3cccc1
CC1=C(C2=CC=CC=C2N1CC=C)C=C3C(=O)N4C(C5=C(C6=CC=CC=C6CC5)N=C4S3)C7=CC=C(C=C7)OC
InChI=1SC34H29N3O2Sc14193621(2)28(2611781229(26)36)203033(38)3732(23131624(393)171423)271815229561025(22)31(27)3534(37)4030h41416172032H1151819H223H3b3020
MFCD28951269
ZINC000003772328
ZINC000003772330
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