Vitas-M small molecule compound
tetraethyl 5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK508434
SMILES CCOC(=O)C1=C(SC2(S1)C(=C(SC1=C2c2ccccc2NC1(C)C)C(=O)OCC)C(=O)OCC)C(=O)OCC
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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 C28H31NO8S3 MW 605.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO8S3/c1-7-34-23(30)18-19(24(31)35-8-2)38-22-17(15-13-11-12-14-16(15)29-27(22,5)6)28(18)39-20(25(32)36-9-3)21(40-28)26(33)37-10-4/h11-14,29H,7-10H2,1-6H3InChIKey
LXZROVFHCSMGIF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C(C13SC(=C(S3)C(=O)OCC)C(=O)OCC)C4=CC=CC=C4NC2(C)C)C(=O)OCC
InChI=1SC28H31NO8S3c173423(30)1819(24(31)3582)382217(151311121416(15)2927(225)6)28(18)3920(25(32)3693)21(4028)26(33)37104h111429H710H216H3
MFCD02691390
tetraethyl55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetraethyl55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetraethyl55dimethylspiro(13dithiole216Hthiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000102131211
ZINC102131211
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