Vitas-M small molecule compound

ethyl 2-{[({2-[3-(propan-2-yloxy)phenyl]quinolin-4-yl}carbonyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK317723
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2cc(nc3c2cccc3)c2cccc(c2)OC(C)C)sc2c1CCCC2

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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 C31H31N3O4S2 MW 573.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O4S2/c1-4-37-30(36)27-22-13-6-8-15-26(22)40-29(27)34-31(39)33-28(35)23-17-25(32-24-14-7-5-12-21(23)24)19-10-9-11-20(16-19)38-18(2)3/h5,7,9-12,14,16-18H,4,6,8,13,15H2,1-3H3,(H2,33,34,35,39)
InChIKey
ACDZVMMAQNFXIB-UHFFFAOYSA-N
Synonyms
445237-47-8
445237478
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)OC(C)C
ethyl2((((2(3(propan2yloxy)phenyl)quinolin4yl)carbonyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2(3propan2yloxyphenyl)quinoline4carbonyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC31H31N3O4S2c143730(36)272213681526(22)4029(27)3431(39)3328(35)231725(322414751221(23)24)191091120(1619)3818(2)3h57912141618H4681315H213H3(H233343539)
MFCD02608956
ZINC000002108611
ZINC02108611
ZINC2108611

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Available files

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