Vitas-M small molecule compound
tetramethyl 8'-methoxy-5',5'-dimethyl-6'-[(4-nitrophenyl)carbonyl]-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK789164
SMILES COc1ccc2c(c1)N(C(=O)c1ccc(cc1)[N+](=O)[O-])C(C1=C2C2(SC(=C(S2)C(=O)OC)C(=O)OC)C(=C(S1)C(=O)OC)C(=O)OC)(C)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 C32H28N2O12S3 MW 728.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N2O12S3/c1-31(2)25-20(18-13-12-17(42-3)14-19(18)33(31)26(35)15-8-10-16(11-9-15)34(40)41)32(21(27(36)43-4)22(47-25)28(37)44-5)48-23(29(38)45-6)24(49-32)30(39)46-7/h8-14H,1-7H3InChIKey
NYUQCIPBPIANLY-UHFFFAOYSA-NSynonyms
CC1(C2=C(C3=C(N1C(=O)C4=CC=C(C=C4)(N+)(=O)(O))C=C(C=C3)OC)C5(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S5)C(=O)OC)C(=O)OC)C
COc1ccc2c(c1)N(C(=O)c1ccc(cc1)(N+)(=O)(O))C(C1=C2C2(SC(=C(S2)C(=O)OC)C(=O)OC)C(=C(S1)C(=O)OC)C(=O)OC)(C)C
InChI=1SC32H28N2O12S3c131(2)2520(18131217(423)1419(18)33(31)26(35)1581016(11915)34(40)41)32(21(27(36)434)22(4725)28(37)445)4823(29(38)456)24(4932)30(39)467h814H17H3
MFCD00621802
tetramethyl8methoxy55dimethyl6((4nitrophenyl)carbonyl)56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl8methoxy55dimethyl6(4nitrobenzoyl)56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl8methoxy55dimethyl6(4nitrobenzoyl)spiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000008434903
ZINC08434903
ZINC8434903
Check stock
See real-time availability and sample size for STK789164 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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