Vitas-M small molecule compound
N-[2-({3,4-dioxo-2-[(pyridin-2-ylmethyl)amino]cyclobut-1-en-1-yl}amino)ethyl]-1H-indole-2-carboxamide
Catalog ID
STL161913
SMILES O=C1C(=O)C(=C1NCc1ccccn1)NCCNC(=O)c1cc2c([nH]1)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 C21H19N5O3 MW 389.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O3/c27-19-17(18(20(19)28)25-12-14-6-3-4-8-22-14)23-9-10-24-21(29)16-11-13-5-1-2-7-15(13)26-16/h1-8,11,23,25-26H,9-10,12H2,(H,24,29)InChIKey
OJUHYFDEQDOZLI-UHFFFAOYSA-NSynonyms
1282132-45-91282132459
C1=CC=C2C(=C1)C=C(N2)C(=O)NCCNC3=C(C(=O)C3=O)NCC4=CC=CC=N4
InChI=1SC21H19N5O3c271917(18(20(19)28)25121463482214)239102421(29)161113512715(13)2616h1811232526H91012H2(H2429)
MFCD18799261
N(2((34dioxo2((pyridin2ylmethyl)amino)cyclobut1en1yl)amino)ethyl)1Hindole2carboxamide
N(2((34dioxo2(pyridin2ylmethylamino)cyclobuten1yl)amino)ethyl)1Hindole2carboxamide
O=C1C(=O)C(=C1NCc1ccccn1)NCCNC(=O)c1cc2c((nH)1)cccc2
ZINC000101699973
ZINC101699973
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