Vitas-M small molecule compound

N-benzyl-5-hydroxy-1,2,3,4-tetrahydro[1]benzothieno[3'',2'':5',6']pyrimido[1',2':1,5]pyrrolo[2,3-b]quinoxaline-7-carboxamide

Catalog ID
STK632921
SMILES O=C(c1c2nc(O)c3c(n2c2c1nc1ccccc1n2)sc1c3CCCC1)NCc1ccccc1

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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 C27H21N5O2S MW 479.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N5O2S/c33-25(28-14-15-8-2-1-3-9-15)21-22-24(30-18-12-6-5-11-17(18)29-22)32-23(21)31-26(34)20-16-10-4-7-13-19(16)35-27(20)32/h1-3,5-6,8-9,11-12H,4,7,10,13-14H2,(H,28,33)(H,31,34)
InChIKey
DPEUNDGHMUIMFR-UHFFFAOYSA-N
Synonyms
488087-99-6
488087996
C1CCC2=C(C1)C3=C(S2)N4C(=C(C5=NC6=CC=CC=C6N=C54)C(=O)NCC7=CC=CC=C7)NC3=O
InChI=1SC27H21N5O2Sc3325(2814158213915)212224(301812651117(18)2922)3223(21)3126(34)201610471319(16)3527(20)32h1356891112H47101314H2(H2833)(H3134)
MFCD18159933
Nbenzyl5hydroxy1234tetrahydro(1)benzothieno(3256)pyrimido(1215)pyrrolo(23b)quinoxaline7carboxamide
ZINC000002325150
ZINC2325150

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Available files

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