Vitas-M small molecule compound

3-chloro-N-{[4-(pyrrolidin-1-ylsulfonyl)phenyl]carbamothioyl}-1-benzothiophene-2-carboxamide

Catalog ID
STK078034
SMILES S=C(NC(=O)c1sc2c(c1Cl)cccc2)Nc1ccc(cc1)S(=O)(=O)N1CCCC1

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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 C20H18ClN3O3S3 MW 480.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN3O3S3/c21-17-15-5-1-2-6-16(15)29-18(17)19(25)23-20(28)22-13-7-9-14(10-8-13)30(26,27)24-11-3-4-12-24/h1-2,5-10H,3-4,11-12H2,(H2,22,23,25,28)
InChIKey
CHQJKLNETSXEJV-UHFFFAOYSA-N
Synonyms
497091-58-4
3CHLORON((4(PYRROLIDIN1YLSULFONYL)PHENYL)CARBAMOTHIOYL)1BENZOTHIOPHENE2CARBOXAMIDE
3CHLORON((4(PYRROLIDIN1YLSULFONYL)PHENYL)CARBAMOTHIOYL)BENZO(B)THIOPHENE2CARBOXAMIDE
3CHLORON((4PYRROLIDIN1YLSULFONYLPHENYL)CARBAMOTHIOYL)1BENZOTHIOPHENE2CARBOXAMIDE
497091584
C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl
InChI=1SC20H18ClN3O3S3c211715512616(15)2918(17)19(25)2320(28)22137914(10813)30(2627)2411341224h12510H341112H2(H222232528)
MFCD03587581
N((3CHLORO1BENZOTHIEN2YL)CARBONYL)N(4(PYRROLIDIN1YLSULFONYL)PHENYL)THIOUREA
S=C(NC(=O)c1sc2c(c1Cl)cccc2)Nc1ccc(cc1)S(=O)(=O)N1CCCC1
STK078034
ZINC000000675703
ZINC00675703
ZINC675703

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Available files

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