Vitas-M small molecule compound
7-methyl-4-[(4-methylphenyl)sulfonyl]-N-(pyridin-3-yl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Catalog ID
STL385536
SMILES O=C(C1Oc2cc(C)ccc2N(C1)S(=O)(=O)c1ccc(cc1)C)Nc1cccnc1
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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 C22H21N3O4S MW 423.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O4S/c1-15-5-8-18(9-6-15)30(27,28)25-14-21(22(26)24-17-4-3-11-23-13-17)29-20-12-16(2)7-10-19(20)25/h3-13,21H,14H2,1-2H3,(H,24,26)InChIKey
NFQPSDNTYSXPCP-UHFFFAOYSA-NSynonyms
7methyl4((4methylphenyl)sulfonyl)N(pyridin3yl)34dihydro2H14benzoxazine2carboxamide
7methyl4(4methylphenyl)sulfonylNpyridin3yl23dihydro14benzoxazine2carboxamide
CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=C2C=CC(=C3)C)C(=O)NC4=CN=CC=C4
InChI=1SC22H21N3O4Sc1155818(9615)30(2728)251421(22(26)24174311231317)29201216(2)71019(20)25h31321H14H212H3(H2426)
MFCD27217571
ZINC000064986036
ZINC000064986037
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