Vitas-M small molecule compound
N-(4-methoxyphenyl)-1-(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Catalog ID
STL001264
SMILES COc1ccc(cc1)NC(=S)c1n2cc(n3c2c(c1c1ccc(cc1)C)CCCC3)c1ccccc1
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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 C31H29N3OS MW 491.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3OS/c1-21-11-13-23(14-12-21)28-26-10-6-7-19-33-27(22-8-4-3-5-9-22)20-34(31(26)33)29(28)30(36)32-24-15-17-25(35-2)18-16-24/h3-5,8-9,11-18,20H,6-7,10,19H2,1-2H3,(H,32,36)InChIKey
QIWUFCQFCDQUCM-UHFFFAOYSA-NSynonyms
497229-00-2497229002
CC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=CC=C5)C(=S)NC6=CC=C(C=C6)OC
InChI=1SC31H29N3OSc121111323(141221)28261067193327(228435922)2034(31(26)33)29(28)30(36)3224151725(352)181624h3589111820H671019H212H3(H3236)
MFCD03300471
N(4methoxyphenyl)1(4methylphenyl)4phenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
N(4methoxyphenyl)4phenyl1(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
ZINC000001760294
ZINC01760294
ZINC1760294
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