Vitas-M small molecule compound

3-{(Z)-[3-(2-chlorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-{[3-(propan-2-yloxy)propyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK881176
SMILES CC(OCCCNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccccc1Cl)C

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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 C26H27ClN4O3S2 MW 543.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27ClN4O3S2/c1-16(2)34-13-7-11-28-22-19(24(32)30-12-6-8-17(3)23(30)29-22)14-21-25(33)31(26(35)36-21)15-18-9-4-5-10-20(18)27/h4-6,8-10,12,14,16,28H,7,11,13,15H2,1-3H3/b21-14-
InChIKey
WMHWXMUWUPDHNO-STZFKDTASA-N
Synonyms
836644-81-6
(5Z)3((2CHLOROPHENYL)METHYL)5((9METHYL4OXO2(3PROPAN2YLOXYPROPYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(2chlorobenzyl)5((2((3isopropoxypropyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(2chlorobenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2((3(propan2yloxy)propyl)amino)4Hpyrido(12a)pyrimidin4one
836644816
CC(OCCCNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccccc1Cl)C
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4Cl)NCCCOC(C)C
InChI=1SC26H27ClN4O3S2c116(2)3413711282219(24(32)30126817(3)23(30)2922)142125(33)31(26(35)3621)15189451020(18)27h4681012141628H7111315H213H3b2114
MFCD03691376
ZINC000101015948
ZINC101015948

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Available files

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