Vitas-M small molecule compound
3-chloro-5-(4-methylphenyl)-2-(thiophen-2-yl)-1-benzoxepine
Catalog ID
STK874097
SMILES Cc1ccc(cc1)C1=CC(=C(Oc2c1cccc2)c1cccs1)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 C21H15ClOS MW 350.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15ClOS/c1-14-8-10-15(11-9-14)17-13-18(22)21(20-7-4-12-24-20)23-19-6-3-2-5-16(17)19/h2-13H,1H3InChIKey
LRNKYFPRNDHQDH-UHFFFAOYSA-NSynonyms
3chloro2(thiophen2yl)5(ptolyl)benzo(b)oxepine
3chloro5(4methylphenyl)2(thiophen2yl)1benzoxepine
3CHLORO5(4METHYLPHENYL)2THIEN2YL1BENZOXEPINE
3CHLORO5(4METHYLPHENYL)2THIOPHEN2YL1BENZOXEPINE
CC1=CC=C(C=C1)C2=CC(=C(OC3=CC=CC=C32)C4=CC=CS4)Cl
InChI=1SC21H15ClOSc11481015(11914)171318(22)21(2074122420)2319632516(17)19h213H1H3
MFCD00840090
ZINC000002294565
ZINC02294565
ZINC2294565
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