Vitas-M small molecule compound
1-{(E)-[2-(1,3-benzothiazol-2-yl)hydrazinylidene]methyl}-17-benzyl-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name)
Catalog ID
STK279223
SMILES O=C1N(Cc2ccccc2)C(=O)C2C1C1c3ccccc3C2(c2c1cccc2)/C=N/Nc1nc2c(s1)cccc2
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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 C33H24N4O2S MW 540.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H24N4O2S/c38-30-28-27-21-12-4-6-14-23(21)33(24-15-7-5-13-22(24)27,19-34-36-32-35-25-16-8-9-17-26(25)40-32)29(28)31(39)37(30)18-20-10-2-1-3-11-20/h1-17,19,27-29H,18H2,(H,35,36)/b34-19+InChIKey
ZTIFAPRUGODDSV-ALQBTCKLSA-NSynonyms
1((E)(2(13benzothiazol2yl)hydrazinylidene)methyl)17benzyl17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
C1=CC=C(C=C1)CN2C(=O)C3C4C5=CC=CC=C5C(C3C2=O)(C6=CC=CC=C46)C=NNC7=NC8=CC=CC=C8S7
InChI=1SC33H24N4O2Sc383028272112461423(21)33(2415751322(24)2719343632352516891726(25)4032)29(28)31(39)37(30)1820102131120h117192729H18H2(H3536)b3419+
MFCD04341153
O=C1N(Cc2ccccc2)C(=O)C2C1C1c3ccccc3C2(c2c1cccc2)C=NNc1nc2c(s1)cccc2
ZINC000097965467
ZINC000097965470
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