Vitas-M small molecule compound
N-benzyl-1,4-bis(4-chlorophenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Catalog ID
STK783843
SMILES Clc1ccc(cc1)c1c(C(=S)NCc2ccccc2)n2c3c1CCCCn3c(c2)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 C30H25Cl2N3S MW 530.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25Cl2N3S/c31-23-13-9-21(10-14-23)26-19-35-28(29(36)33-18-20-6-2-1-3-7-20)27(22-11-15-24(32)16-12-22)25-8-4-5-17-34(26)30(25)35/h1-3,6-7,9-16,19H,4-5,8,17-18H2,(H,33,36)InChIKey
RYKMVFNTVHRYAS-UHFFFAOYSA-NSynonyms
380442-16-0380442160
C1CCN2C(=CN3C2=C(C1)C(=C3C(=S)NCC4=CC=CC=C4)C5=CC=C(C=C5)Cl)C6=CC=C(C=C6)Cl
InChI=1SC30H25Cl2N3Sc312313921(101423)26193528(29(36)3318206213720)27(22111524(32)161222)258451734(26)30(25)35h136791619H4581718H2(H3336)
MFCD03305312
Nbenzyl14bis(4chlorophenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
ZINC000003228749
ZINC3228749
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