Vitas-M small molecule compound

1-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylurea

Catalog ID
STK527738
SMILES CCCCSc1nc2c(s1)cc(cc2)NC(=O)Nc1ccccc1

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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 C18H19N3OS2 MW 357.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3OS2/c1-2-3-11-23-18-21-15-10-9-14(12-16(15)24-18)20-17(22)19-13-7-5-4-6-8-13/h4-10,12H,2-3,11H2,1H3,(H2,19,20,22)
InChIKey
ZTRXQDFHWGEAKR-UHFFFAOYSA-N
Synonyms
331244-37-2
1(2(butylsulfanyl)13benzothiazol6yl)3phenylurea
1(2(butylthio)benzo(d)thiazol6yl)3phenylurea
1(2BUTYLSULFANYL13BENZOTHIAZOL6YL)3PHENYLUREA
331244372
CCCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)NC3=CC=CC=C3
InChI=1SC18H19N3OS2c123112318211510914(1216(15)2418)2017(22)19137546813h41012H2311H21H3(H2192022)
MFCD00613449
ZINC000002274822
ZINC02274822
ZINC2274822

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Available files

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