Vitas-M small molecule compound
6-chloro-N-(3-methylbutyl)-4-[(4-methylphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Catalog ID
STL385615
SMILES CC(CCNC(=O)C1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)C)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 C21H25ClN2O4S MW 436.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN2O4S/c1-14(2)10-11-23-21(25)20-13-24(18-12-16(22)6-9-19(18)28-20)29(26,27)17-7-4-15(3)5-8-17/h4-9,12,14,20H,10-11,13H2,1-3H3,(H,23,25)InChIKey
NAJPEVZSVQYVDT-UHFFFAOYSA-NSynonyms
6chloroN(3methylbutyl)4((4methylphenyl)sulfonyl)34dihydro2H14benzoxazine2carboxamide
6chloroN(3methylbutyl)4(4methylphenyl)sulfonyl23dihydro14benzoxazine2carboxamide
CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=C2C=C(C=C3)Cl)C(=O)NCCC(C)C
InChI=1SC21H25ClN2O4Sc114(2)10112321(25)201324(181216(22)6919(18)2820)29(2627)177415(3)5817h49121420H101113H213H3(H2325)
MFCD27217647
ZINC000064986194
ZINC000064986195
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