Vitas-M small molecule compound
2-(3-methylphenyl)-6,7,8,9-tetrahydro-4H,5H-cyclohepta[4,5]thieno[2,3-d][1,3]oxazin-4-one
Catalog ID
STK078309
SMILES Cc1cccc(c1)c1oc(=O)c2c(n1)sc1c2CCCCC1
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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 C18H17NO2S MW 311.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO2S/c1-11-6-5-7-12(10-11)16-19-17-15(18(20)21-16)13-8-3-2-4-9-14(13)22-17/h5-7,10H,2-4,8-9H2,1H3InChIKey
QWEIJOXSWGAPCM-UHFFFAOYSA-NSynonyms
2(3methylphenyl)6789tetrahydro4H5Hcyclohepta(45)thieno(23d)(13)oxazin4one
2(3methylphenyl)6789tetrahydro5Hcyclohepta(23)thieno(24b)(13)oxazin4one
CC1=CC=CC(=C1)C2=NC3=C(C4=C(S3)CCCCC4)C(=O)O2
Cc1cccc(c1)c1oc(=O)c2c(n1)sc1c2CCCCC1
InChI=1SC18H17NO2Sc11165712(1011)16191715(18(20)2116)138324914(13)2217h5710H2489H21H3
MFCD01823777
STK078309
ZINC000000130319
ZINC00130319
ZINC130319
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