Vitas-M small molecule compound
N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1,2-bis(propylsulfonyl)pyrrolo[2,1-a]isoquinoline-3-carbohydrazide
Catalog ID
STK673555
SMILES CCCS(=O)(=O)c1c(C(=O)N/N=C/C=C/c2ccccc2)n2c(c1S(=O)(=O)CCC)c1ccccc1cc2
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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 C28H29N3O5S2 MW 551.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O5S2/c1-3-19-37(33,34)26-24-23-15-9-8-14-22(23)16-18-31(24)25(27(26)38(35,36)20-4-2)28(32)30-29-17-10-13-21-11-6-5-7-12-21/h5-18H,3-4,19-20H2,1-2H3,(H,30,32)/b13-10+,29-17+InChIKey
TXSUHKOEPRSLNU-UECKQEGESA-NSynonyms
CCCS(=O)(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1S(=O)(=O)CCC)C(=O)NN=CC=CC4=CC=CC=C4
CCCS(=O)(=O)c1c(C(=O)NN=CC=Cc2ccccc2)n2c(c1S(=O)(=O)CCC)c1ccccc1cc2
InChI=1SC28H29N3O5S2c131937(3334)26242315981422(23)161831(24)25(27(26)38(3536)2042)28(32)302917101321116571221h518H341920H212H3(H3032)b1310+2917+
MFCD01152800
N((1E2E)3phenylprop2en1ylidene)12bis(propylsulfonyl)pyrrolo(21a)isoquinoline3carbohydrazide
N((E)((E)3PHENYLPROP2ENYLIDENE)AMINO)12BIS(PROPYLSULFONYL)PYRROLO(21A)ISOQUINOLINE3CARBOXAMIDE
N(3PHENYL2PROPENYLIDENE)12BIS(PROPYLSULFONYL)PYRROLO(21A)ISOQUINOLINE3CARBOHYDRAZIDE
ZINC000002188315
ZINC102778465
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