Vitas-M small molecule compound
(3E)-6-chloro-3-[2-(2,4-dimethylphenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Catalog ID
STL442915
SMILES Cc1ccc(c(c1)C)C(=O)/C=c\1/[nH]c2cc(Cl)ccc2oc1=O
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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 C18H14ClNO3 MW 327.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14ClNO3/c1-10-3-5-13(11(2)7-10)16(21)9-15-18(22)23-17-6-4-12(19)8-14(17)20-15/h3-9,20H,1-2H3/b15-9+InChIKey
NQFBSEFHVKLEKA-OQLLNIDSSA-NSynonyms
(3E)6chloro3(2(24dimethylphenyl)2oxoethylidene)34dihydro2H14benzoxazin2one
(3E)6chloro3(2(24dimethylphenyl)2oxoethylidene)4H14benzoxazin2one
CC1=CC(=C(C=C1)C(=O)C=C2C(=O)OC3=C(N2)C=C(C=C3)Cl)C
Cc1ccc(c(c1)C)C(=O)C=c1(nH)c2cc(Cl)ccc2oc1=O
InChI=1SC18H14ClNO3c1103513(11(2)710)16(21)91518(22)23176412(19)814(17)2015h3920H12H3b159+
MFCD14742058
ZINC000101356169
ZINC101356169
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