Vitas-M small molecule compound
1-(4-chlorophenyl)-N-(3-methylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Catalog ID
STK769979
SMILES Clc1ccc(cc1)c1c2CCCCn3c2n(c1C(=S)Nc1cccc(c1)C)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 C30H26ClN3S MW 496.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26ClN3S/c1-20-8-7-11-24(18-20)32-29(35)28-27(22-13-15-23(31)16-14-22)25-12-5-6-17-33-26(19-34(28)30(25)33)21-9-3-2-4-10-21/h2-4,7-11,13-16,18-19H,5-6,12,17H2,1H3,(H,32,35)InChIKey
QPWJJFSFGNBGPK-UHFFFAOYSA-NSynonyms
1(4chlorophenyl)N(3methylphenyl)4phenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
CC1=CC(=CC=C1)NC(=S)C2=C(C3=C4N2C=C(N4CCCC3)C5=CC=CC=C5)C6=CC=C(C=C6)Cl
InChI=1SC30H26ClN3Sc120871124(1820)3229(35)2827(22131523(31)161422)251256173326(1934(28)30(25)33)2193241021h2471113161819H561217H21H3(H3235)
MFCD02252922
ZINC000003622693
ZINC03622693
ZINC3622693
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