Vitas-M small molecule compound

3-{[3-(methoxycarbonyl)thiophen-2-yl]carbamoyl}-7-(propan-2-ylidene)bicyclo[2.2.1]heptane-2-carboxylic acid

Catalog ID
STK441250
SMILES COC(=O)c1ccsc1NC(=O)C1C(C(=O)O)C2C(=C(C)C)C1CC2

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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 C18H21NO5S MW 363.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO5S/c1-8(2)12-9-4-5-10(12)14(17(21)22)13(9)15(20)19-16-11(6-7-25-16)18(23)24-3/h6-7,9-10,13-14H,4-5H2,1-3H3,(H,19,20)(H,21,22)
InChIKey
AESCBCIBMTZBCE-UHFFFAOYSA-N
Synonyms

2((3METHOXYCARBONYLTHIOPHEN2YL)CARBAMOYL)7PROPAN2YLIDENEBICYCLO(221)HEPTANE3CARBOXYLICACID
3((3(methoxycarbonyl)thiophen2yl)carbamoyl)7(propan2ylidene)bicyclo(221)heptane2carboxylicacid
3(N(3(METHOXYCARBONYL)(2THIENYL))CARBAMOYL)7(METHYLETHYLIDENE)BICYCLO(221)HEPTANE2CARBOXYLICACID
CC(=C1C2CCC1C(C2C(=O)NC3=C(C=CS3)C(=O)OC)C(=O)O)C
InChI=1SC18H21NO5Sc18(2)1294510(12)14(17(21)22)13(9)15(20)191611(672516)18(23)243h679101314H45H213H3(H1920)(H2122)
MFCD03946393
ZINC000102233012
ZINC000102611955

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Available files

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