Vitas-M small molecule compound

N-(1,3-benzothiazol-2-yl)-1-butyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide

Catalog ID
STK072752
SMILES CCCCn1c(=O)c(C(=O)Nc2nc3c(s2)cccc3)c(c2c1cccc2)O

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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 C21H19N3O3S MW 393.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O3S/c1-2-3-12-24-15-10-6-4-8-13(15)18(25)17(20(24)27)19(26)23-21-22-14-9-5-7-11-16(14)28-21/h4-11,25H,2-3,12H2,1H3,(H,22,23,26)
InChIKey
JRZXLRLSSSDVJZ-UHFFFAOYSA-N
Synonyms
312942-02-2
312942022
CCCCn1c(=O)c(C(=O)Nc2nc3c(s2)cccc3)c(c2c1cccc2)O
CCCCN1C2=CC=CC=C2C(=C(C1=O)C(=O)NC3=NC4=CC=CC=C4S3)O
InChI=1SC21H19N3O3Sc1231224151064813(15)18(25)17(20(24)27)19(26)232122149571116(14)2821h41125H2312H21H3(H222326)
MFCD00805746
N(13BENZOTHIAZOL2YL)1BUTYL2HYDROXY4OXOQUINOLINE3CARBOXAMIDE
N(13BENZOTHIAZOL2YL)1BUTYL4HYDROXY2OXO12DIHYDROQUINOLINE3CARBOXAMIDE
N(13benzothiazol2yl)1butyl4hydroxy2oxoquinoline3carboxamide
N(benzo(d)thiazol2yl)1butyl4hydroxy2oxo12dihydroquinoline3carboxamide
STK072752
ZINC000100702698
ZINC100702698

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.