Vitas-M small molecule compound

N-{[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-3,4,5-trimethoxybenzamide

Catalog ID
STK163542
SMILES COc1cc(cc(c1OC)OC)C(=O)NC(=S)Nc1cccc(c1)c1nc2c(o1)ccc(c2)Cl

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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 C24H20ClN3O5S MW 497.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O5S/c1-30-19-10-14(11-20(31-2)21(19)32-3)22(29)28-24(34)26-16-6-4-5-13(9-16)23-27-17-12-15(25)7-8-18(17)33-23/h4-12H,1-3H3,(H2,26,28,29,34)
InChIKey
IGTJGJJFTKDULW-UHFFFAOYSA-N
Synonyms
6382-77-0
1(3(5CHLOROBENZOOXAZOL2YL)PHENYL)3(345TRIMETHOXYBENZOYL)THIOUREA
6382770
COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=CC=CC(=C2)C3=NC4=C(O3)C=CC(=C4)Cl
InChI=1SC24H20ClN3O5Sc130191014(1120(312)21(19)323)22(29)2824(34)261664513(916)2327171215(25)7818(17)3323h412H13H3(H226282934)
MFCD02734573
N(((3(5CHLOROBENZOXAZOL2YL)PHENYL)AMINO)THIOXOMETHYL)(345TRIMETHOXYPHENYL)CARBOXAMIDE
N((3(5CHLORO13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)345TRIMETHOXYBENZAMIDE
ZINC000000881711
ZINC00881711
ZINC881711

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Available files

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