Vitas-M small molecule compound
(6Z)-5-imino-6-({1-[3-(3-methoxyphenoxy)propyl]-1H-indol-3-yl}methylidene)-2-[(2-methylphenoxy)methyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK727516
SMILES COc1cccc(c1)OCCCn1cc(c2c1cccc2)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1C
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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 C32H29N5O4S MW 579.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N5O4S/c1-21-9-3-6-14-28(21)41-20-29-35-37-30(33)26(31(38)34-32(37)42-29)17-22-19-36(27-13-5-4-12-25(22)27)15-8-16-40-24-11-7-10-23(18-24)39-2/h3-7,9-14,17-19,33H,8,15-16,20H2,1-2H3/b26-17-,33-30-InChIKey
ZUSFCRQJSHCKMR-PEBYHUBMSA-NSynonyms
(6Z)5imino6((1(3(3methoxyphenoxy)propyl)1Hindol3yl)methylidene)2((2methylphenoxy)methyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)5imino6((1(3(3methoxyphenoxy)propyl)1Hindol3yl)methylene)2((otolyloxy)methyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
COc1cccc(c1)OCCCn1cc(c2c1cccc2)C=C1C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1C
MFCD03571728
ZINC000097964934
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