Vitas-M small molecule compound
N-(2,6-dimethylphenyl)-1-(4-methoxyphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Catalog ID
STL006894
SMILES COc1ccc(cc1)c1c2CCCCn3c2n(c1C(=S)Nc1c(C)cccc1C)cc3c1ccccc1
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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 C32H31N3OS MW 505.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3OS/c1-21-10-9-11-22(2)29(21)33-31(37)30-28(24-15-17-25(36-3)18-16-24)26-14-7-8-19-34-27(20-35(30)32(26)34)23-12-5-4-6-13-23/h4-6,9-13,15-18,20H,7-8,14,19H2,1-3H3,(H,33,37)InChIKey
LHXVSRCDLXKHKV-UHFFFAOYSA-NSynonyms
497232-28-7497232287
CC1=C(C(=CC=C1)C)NC(=S)C2=C(C3=C4N2C=C(N4CCCC3)C5=CC=CC=C5)C6=CC=C(C=C6)OC
InChI=1SC32H31N3OSc1211091122(2)29(21)3331(37)3028(24151725(363)181624)261478193427(2035(30)32(26)34)23125461323h46913151820H781419H213H3(H3337)
MFCD03300763
N(26dimethylphenyl)1(4methoxyphenyl)4phenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
ZINC000002447742
ZINC02447742
ZINC2447742
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