Vitas-M small molecule compound

2-{[(3-iodo-4-methylphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STK013988
SMILES O=C(c1ccc(c(c1)I)C)Nc1sc2c(c1C(=O)N)CCCC2

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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 C17H17IN2O2S MW 440.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17IN2O2S/c1-9-6-7-10(8-12(9)18)16(22)20-17-14(15(19)21)11-4-2-3-5-13(11)23-17/h6-8H,2-5H2,1H3,(H2,19,21)(H,20,22)
InChIKey
FIJJNMKOKRXBOV-UHFFFAOYSA-N
Synonyms

2(((3iodo4methylphenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxamide
2((3iodo4methylbenzoyl)amino)4567tetrahydro1benzothiophene3carboxamide
CC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N)I
InChI=1SC17H17IN2O2Sc196710(812(9)18)16(22)201714(15(19)21)11423513(11)2317h68H25H21H3(H21921)(H2022)
MFCD03405807
O=C(c1ccc(c(c1)I)C)Nc1sc2c(c1C(=O)N)CCCC2
STK013988
ZINC000000675408
ZINC00675408
ZINC675408

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.