Vitas-M small molecule compound
1-(4-methylphenyl)-N,4-diphenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Catalog ID
STK532131
SMILES Cc1ccc(cc1)c1c2CCCCn3c2n(c1C(=S)Nc1ccccc1)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 C30H27N3S MW 461.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3S/c1-21-15-17-23(18-16-21)27-25-14-8-9-19-32-26(22-10-4-2-5-11-22)20-33(30(25)32)28(27)29(34)31-24-12-6-3-7-13-24/h2-7,10-13,15-18,20H,8-9,14,19H2,1H3,(H,31,34)InChIKey
YDKULAKXZXGTQM-UHFFFAOYSA-NSynonyms
325996-53-01(4methylphenyl)N4diphenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
325996530
CC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=CC=C5)C(=S)NC6=CC=CC=C6
InChI=1SC30H27N3Sc121151723(181621)27251489193226(22104251122)2033(30(25)32)28(27)29(34)3124126371324h271013151820H891419H21H3(H3134)
MFCD01946040
N4diphenyl1(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
ZINC000002279683
ZINC02279683
ZINC2279683
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