Vitas-M small molecule compound
1,4-bis[(pentamethylphenyl)sulfonyl]-1,4-diazepane
Catalog ID
STK449466
SMILES Cc1c(C)c(C)c(c(c1S(=O)(=O)N1CCCN(CC1)S(=O)(=O)c1c(C)c(C)c(c(c1C)C)C)C)C
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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 C27H40N2O4S2 MW 520.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H40N2O4S2/c1-16-18(3)22(7)26(23(8)19(16)4)34(30,31)28-12-11-13-29(15-14-28)35(32,33)27-24(9)20(5)17(2)21(6)25(27)10/h11-15H2,1-10H3InChIKey
DQAZUCZPQKXIPR-UHFFFAOYSA-NSynonyms
14bis((23456pentamethylphenyl)sulfonyl)14diazepane
14bis((pentamethylphenyl)sulfonyl)14diazepane
CC1=C(C(=C(C(=C1C)C)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=C(C(=C(C(=C3C)C)C)C)C)C)C
InChI=1SC27H40N2O4S2c11618(3)22(7)26(23(8)19(16)4)34(3031)2812111329(151428)35(3233)2724(9)20(5)17(2)21(6)25(27)10h1115H2110H3
MFCD03468193
ZINC000000653754
ZINC00653754
ZINC653754
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