Vitas-M small molecule compound

(3R)-N-[3-(1H-indol-5-ylamino)-3-oxopropyl]-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide

Catalog ID
STK645580
SMILES O=C(Nc1ccc2c(c1)cc[nH]2)CCNC(=O)[C@@H]1CSC2N1C(=O)c1c2cccc1

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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 C22H20N4O3S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3S/c27-19(25-14-5-6-17-13(11-14)7-9-23-17)8-10-24-20(28)18-12-30-22-16-4-2-1-3-15(16)21(29)26(18)22/h1-7,9,11,18,22-23H,8,10,12H2,(H,24,28)(H,25,27)/t18-,22?/m0/s1
InChIKey
JXNRDJZZTBNQSN-HXBUSHRASA-N
Synonyms
1014412-02-2
(3R)N(3((1Hindol5yl)amino)3oxopropyl)5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
(3R)N(3(1Hindol5ylamino)3oxopropyl)5oxo2359btetrahydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N(3(1Hindol5ylamino)3oxopropyl)5oxo39bdihydro2H(13)thiazolo(23a)isoindole3carboxamide
1014412022
C1C(N2C(S1)C3=CC=CC=C3C2=O)C(=O)NCCC(=O)NC4=CC5=C(C=C4)NC=C5
InChI=1SC22H20N4O3Sc2719(2514561713(1114)792317)8102420(28)1812302216421315(16)21(29)26(18)22h17911182223H81012H2(H2428)(H2527)t1822?m0s1
MFCD10488976
O=C(Nc1ccc2c(c1)cc(nH)2)CCNC(=O)(C@@H)1CSC2N1C(=O)c1c2cccc1
ZINC000013692537
ZINC000013692538

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Available files

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