Vitas-M small molecule compound
(6Z)-5-imino-2-[(2-methylphenoxy)methyl]-6-({1-[3-(3-methylphenoxy)propyl]-1H-indol-3-yl}methylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK727577
SMILES Cc1cccc(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 C32H29N5O3S MW 563.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N5O3S/c1-21-9-7-11-24(17-21)39-16-8-15-36-19-23(25-12-4-5-13-27(25)36)18-26-30(33)37-32(34-31(26)38)41-29(35-37)20-40-28-14-6-3-10-22(28)2/h3-7,9-14,17-19,33H,8,15-16,20H2,1-2H3/b26-18-,33-30-InChIKey
UPSMESCKIVQPEH-VSVVGCDMSA-NSynonyms
(6Z)5imino2((2methylphenoxy)methyl)6((1(3(3methylphenoxy)propyl)1Hindol3yl)methylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)5imino2((otolyloxy)methyl)6((1(3(mtolyloxy)propyl)1Hindol3yl)methylene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
Cc1cccc(c1)OCCCn1cc(c2c1cccc2)C=C1C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1C
MFCD03572908
ZINC000097964931
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