Vitas-M small molecule compound
1,4-bis(4-chlorophenyl)-N-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Catalog ID
STL005498
SMILES Clc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=S)Nc1ccccc1)c1ccc(cc1)Cl
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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 C29H23Cl2N3S MW 516.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23Cl2N3S/c30-21-13-9-19(10-14-21)25-18-34-27(28(35)32-23-6-2-1-3-7-23)26(20-11-15-22(31)16-12-20)24-8-4-5-17-33(25)29(24)34/h1-3,6-7,9-16,18H,4-5,8,17H2,(H,32,35)InChIKey
YDRROZBWYUBPHX-UHFFFAOYSA-NSynonyms
489401-82-314bis(4chlorophenyl)Nphenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
489401823
C1CCN2C(=CN3C2=C(C1)C(=C3C(=S)NC4=CC=CC=C4)C5=CC=C(C=C5)Cl)C6=CC=C(C=C6)Cl
InChI=1SC29H23Cl2N3Sc302113919(101421)25183427(28(35)32236213723)26(20111522(31)161220)248451733(25)29(24)34h136791618H45817H2(H3235)
MFCD03295942
ZINC000002448558
ZINC02448558
ZINC2448558
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