Vitas-M small molecule compound

2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(4H-1,2,4-triazol-3-yl)benzamide

Catalog ID
STL318492
SMILES O=C(c1ccc(cc1Cl)N1CCCCS1(=O)=O)Nc1nnc[nH]1

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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 C13H14ClN5O3S MW 355.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14ClN5O3S/c14-11-7-9(19-5-1-2-6-23(19,21)22)3-4-10(11)12(20)17-13-15-8-16-18-13/h3-4,7-8H,1-2,5-6H2,(H2,15,16,17,18,20)
InChIKey
DBNGHRPAMNCIOF-UHFFFAOYSA-N
Synonyms
1435907-49-5
1435907495
2chloro4(11dioxido12thiazinan2yl)N(1H124triazol3yl)benzamide
2chloro4(11dioxido12thiazinan2yl)N(4H124triazol3yl)benzamide
2chloro4(11dioxothiazinan2yl)N(1H124triazol5yl)benzamide
C1CCS(=O)(=O)N(C1)C2=CC(=C(C=C2)C(=O)NC3=NC=NN3)Cl
InChI=1SC13H14ClN5O3Sc141179(19512623(1921)22)3410(11)12(20)1713158161813h3478H1256H2(H21516171820)
MFCD28031320
O=C(c1ccc(cc1Cl)N1CCCCS1(=O)=O)Nc1n(nH)cn1
O=C(c1ccc(cc1Cl)N1CCCCS1(=O)=O)Nc1nnc(nH)1
ZINC000095479348
ZINC95479348

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Available files

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