Vitas-M small molecule compound
(2Z)-2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-N-(4-fluorophenyl)-8-methoxy-2H-chromene-3-carboxamide
Catalog ID
STK959508
SMILES COc1cccc2c1o/c(=N\c1sc3c(c1C(=O)N)CCCC3)/c(c2)C(=O)Nc1ccc(cc1)F
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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 C26H22FN3O4S MW 491.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22FN3O4S/c1-33-19-7-4-5-14-13-18(24(32)29-16-11-9-15(27)10-12-16)25(34-22(14)19)30-26-21(23(28)31)17-6-2-3-8-20(17)35-26/h4-5,7,9-13H,2-3,6,8H2,1H3,(H2,28,31)(H,29,32)/b30-25-InChIKey
AKJJAOMWIONDPQ-JVCXMKTPSA-NSynonyms
(2Z)2((3carbamoyl4567tetrahydro1benzothiophen2yl)imino)N(4fluorophenyl)8methoxy2Hchromene3carboxamide
(2Z)2((3carbamoyl4567tetrahydro1benzothiophen2yl)imino)N(4fluorophenyl)8methoxychromene3carboxamide
COC1=CC=CC2=C1OC(=NC3=C(C4=C(S3)CCCC4)C(=O)N)C(=C2)C(=O)NC5=CC=C(C=C5)F
COc1cccc2c1oc(=Nc1sc3c(c1C(=O)N)CCCC3)c(c2)C(=O)Nc1ccc(cc1)F
InChI=1SC26H22FN3O4Sc13319745141318(24(32)291611915(27)101216)25(3422(14)19)302621(23(28)31)17623820(17)3526h457913H2368H21H3(H22831)(H2932)b3025
MFCD01842210
ZINC000017130865
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