Vitas-M small molecule compound
(2'S,3S,3'S,10b'R)-2'-{[2-(prop-2-en-1-yloxy)phenyl]carbonyl}-3'-(thiophen-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Catalog ID
STK578081
SMILES C=CCOc1ccccc1C(=O)[C@@H]1[C@@H](C(=O)c2cccs2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2
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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 C34H26N2O4S MW 558.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H26N2O4S/c1-2-19-40-26-15-8-5-12-23(26)30(37)28-29(31(38)27-16-9-20-41-27)36-18-17-21-10-3-4-11-22(21)32(36)34(28)24-13-6-7-14-25(24)35-33(34)39/h2-18,20,28-29,32H,1,19H2,(H,35,39)/t28-,29-,32+,34+/m0/s1InChIKey
DERASBYEAUQLJN-GGKJBDKJSA-NSynonyms
1212254-21-1(1S2S3S10bR)2(2(allyloxy)benzoyl)3(thiophene2carbonyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)2((2(prop2en1yloxy)phenyl)carbonyl)3(thiophen2ylcarbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)2(2prop2enoxybenzoyl)3(thiophene2carbonyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1212254211
C=CCOC1=CC=CC=C1C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)C7=CC=CS7
C=CCOc1ccccc1C(=O)(C@@H)1(C@@H)(C(=O)c2cccs2)N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2
InChI=1SC34H26N2O4Sc1219402615851223(26)30(37)2829(31(38)27169204127)3618172110341122(21)32(36)34(28)2413671425(24)3533(34)39h21820282932H119H2(H3539)t282932+34+m0s1
MFCD18158134
ZINC000101318712
ZINC101318712
Check stock
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Check stock on Vitas-MAvailable files
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