Vitas-M small molecule compound
N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
Catalog ID
STL172906
SMILES Cc1onc(c1C(=O)Nc1sc2c(c1C(=O)N)CCCCC2)c1ccccc1Cl
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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 C21H20ClN3O3S MW 429.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN3O3S/c1-11-16(18(25-28-11)12-7-5-6-9-14(12)22)20(27)24-21-17(19(23)26)13-8-3-2-4-10-15(13)29-21/h5-7,9H,2-4,8,10H2,1H3,(H2,23,26)(H,24,27)InChIKey
QTXQQGGKXDHLKC-UHFFFAOYSA-NSynonyms
CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC3=C(C4=C(S3)CCCCC4)C(=O)N
InChI=1SC21H20ClN3O3Sc11116(18(252811)12756914(12)22)20(27)242117(19(23)26)1383241015(13)2921h579H24810H21H3(H22326)(H2427)
MFCD03383293
N(3carbamoyl5678tetrahydro4Hcyclohepta(b)thiophen2yl)3(2chlorophenyl)5methyl12oxazole4carboxamide
ZINC000000696066
ZINC00696066
ZINC696066
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