Vitas-M small molecule compound
3-{[(E)-(2-iodophenyl)methylidene]amino}-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK373657
SMILES Ic1ccccc1/C=N/n1c(C)nc2c(c1=O)c1CCCCc1s2
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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 C18H16IN3OS MW 449.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16IN3OS/c1-11-21-17-16(13-7-3-5-9-15(13)24-17)18(23)22(11)20-10-12-6-2-4-8-14(12)19/h2,4,6,8,10H,3,5,7,9H2,1H3/b20-10+InChIKey
QXJKVBQBZUTOLW-KEBDBYFISA-NSynonyms
3(((E)(2iodophenyl)methylidene)amino)2methyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3((E)(2iodophenyl)methylideneamino)2methyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1N=CC4=CC=CC=C4I
Ic1ccccc1C=Nn1c(C)nc2c(c1=O)c1CCCCc1s2
InChI=1SC18H16IN3OSc111211716(13735915(13)2417)18(23)22(11)201012624814(12)19h246810H3579H21H3b2010+
MFCD00688071
ZINC000001881650
ZINC33345773
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