Vitas-M small molecule compound

3-{[(E)-(3-iodophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one

Catalog ID
STK528872
SMILES Ic1cccc(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

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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 C17H11IN4O MW 414.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11IN4O/c18-12-5-3-4-11(8-12)9-20-22-10-19-15-13-6-1-2-7-14(13)21-16(15)17(22)23/h1-10,21H/b20-9+
InChIKey
OFCJSAOMYMGIHJ-AWQFTUOYSA-N
Synonyms
371958-94-0
(E)3((3iodobenzylidene)amino)3Hpyrimido(54b)indol4(5H)one
3(((E)(3iodophenyl)methylidene)amino)35dihydro4Hpyrimido(54b)indol4one
3((E)(3IODOPHENYL)METHYLIDENEAMINO)5HPYRIMIDO(54B)INDOL4ONE
371958940
C1=CC=C2C(=C1)C3=C(N2)C(=O)N(C=N3)N=CC4=CC(=CC=C4)I
Ic1cccc(c1)C=Nn1cnc2c(c1=O)(nH)c1c2cccc1
InChI=1SC17H11IN4Oc181253411(812)9202210191513612714(13)2116(15)17(22)23h11021Hb209+
MFCD01875541
ZINC000002271091
ZINC33352014

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Available files

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