Vitas-M small molecule compound
3-chloro-N-({2-methoxy-5-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}carbamothioyl)benzamide
Catalog ID
STK209795
SMILES COc1ccc(cc1NC(=S)NC(=O)c1cccc(c1)Cl)c1nc2c(o1)ccc(c2)C(C)C
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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 C25H22ClN3O3S MW 479.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O3S/c1-14(2)15-7-10-22-20(12-15)27-24(32-22)17-8-9-21(31-3)19(13-17)28-25(33)29-23(30)16-5-4-6-18(26)11-16/h4-14H,1-3H3,(H2,28,29,30,33)InChIKey
FSWLGVDJQKAREE-UHFFFAOYSA-NSynonyms
(3CHLOROPHENYL)N(((2METHOXY5(5(METHYLETHYL)BENZOXAZOL2YL)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
3CHLORON((2METHOXY5(5(1METHYLETHYL)13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
3CHLORON((2METHOXY5(5(PROPAN2YL)13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
3CHLORON((2METHOXY5(5PROPAN2YL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
CC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)OC)NC(=S)NC(=O)C4=CC(=CC=C4)Cl
InChI=1SC25H22ClN3O3Sc114(2)157102220(1215)2724(3222)178921(313)19(1317)2825(33)2923(30)1654618(26)1116h414H13H3(H228293033)
MFCD03836807
ZINC000004122742
ZINC04122742
ZINC4122742
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