Vitas-M small molecule compound
2-[(3-hydroxypropyl)amino]-3-{(Z)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK876375
SMILES OCCCNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC1CCCO1
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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 C20H22N4O4S2 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O4S2/c25-9-4-7-21-17-14(18(26)23-8-2-1-6-16(23)22-17)11-15-19(27)24(20(29)30-15)12-13-5-3-10-28-13/h1-2,6,8,11,13,21,25H,3-5,7,9-10,12H2/b15-11-InChIKey
OBJDIMNXAGQZBT-PTNGSMBKSA-NSynonyms
(5Z)5((2(3HYDROXYPROPYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(OXOLAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2((3hydroxypropyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3((tetrahydrofuran2yl)methyl)2thioxothiazolidin4one
2((3hydroxypropyl)amino)3((Z)(4oxo3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
C1CC(OC1)CN2C(=O)C(=CC3=C(N=C4C=CC=CN4C3=O)NCCCO)SC2=S
InChI=1SC20H22N4O4S2c25947211714(18(26)23821616(23)2217)111519(27)24(20(29)3015)121353102813h126811132125H35791012H2b1511
MFCD02993833
OCCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)CC1CCCO1
ZINC000002301376
ZINC000002301378
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