Vitas-M small molecule compound
4-{5-[(3-bromobenzyl)sulfanyl]-1H-tetrazol-1-yl}benzoic acid
Catalog ID
STL336131
SMILES Brc1cccc(c1)CSc1nnnn1c1ccc(cc1)C(=O)O
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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 C15H11BrN4O2S MW 391.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11BrN4O2S/c16-12-3-1-2-10(8-12)9-23-15-17-18-19-20(15)13-6-4-11(5-7-13)14(21)22/h1-8H,9H2,(H,21,22)InChIKey
GQWWMGCEDLDJEG-UHFFFAOYSA-NSynonyms
346464-80-0346464800
4(5((3bromobenzyl)sulfanyl)1Htetrazol1yl)benzoicacid
4(5((3BROMOBENZYL)THIO)1HTETRAZOL1YL)BENZOICACID
4(5((3BROMOPHENYL)METHYLSULFANYL)TETRAZOL1YL)BENZOICACID
C1=CC(=CC(=C1)Br)CSC2=NN=NN2C3=CC=C(C=C3)C(=O)O
InChI=1SC15H11BrN4O2Sc161231210(812)9231517181920(15)136411(5713)14(21)22h18H9H2(H2122)
MFCD01580911
ZINC000001154019
ZINC1154019
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