Vitas-M small molecule compound
10-(3-chloro-4-methylphenyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-7,8-dicarbonitrile
Catalog ID
STK687018
SMILES N#Cc1cc2Oc3ccccc3C(=O)N(c2cc1C#N)c1ccc(c(c1)Cl)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 C22H12ClN3O2 MW 385.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12ClN3O2/c1-13-6-7-16(10-18(13)23)26-19-8-14(11-24)15(12-25)9-21(19)28-20-5-3-2-4-17(20)22(26)27/h2-10H,1H3InChIKey
NUTLAAYSWWTGSN-UHFFFAOYSA-NSynonyms
10(3chloro4methylphenyl)11oxo1011dihydrodibenzo(bf)(14)oxazepine78dicarbonitrile
5(3CHLORO4METHYLPHENYL)6OXOBENZO(B)(14)BENZOXAZEPINE23DICARBONITRILE
CC1=C(C=C(C=C1)N2C3=C(C=C(C(=C3)C#N)C#N)OC4=CC=CC=C4C2=O)Cl
InChI=1SC22H12ClN3O2c1136716(1018(13)23)2619814(1124)15(1225)921(19)2820532417(20)22(26)27h210H1H3
MFCD06735548
ZINC000004744516
ZINC04744516
ZINC4744516
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