Vitas-M small molecule compound

S-benzyl-N-{[trans-4-({[(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]amino}methyl)cyclohexyl]carbonyl}-D-cysteine

Catalog ID
STK575371
SMILES COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)NC[C@@H]1CC[C@H](CC1)C(=O)N[C@@H](C(=O)O)CSCc1ccccc1

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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 C31H35ClN2O7S MW 615.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35ClN2O7S/c1-18-22-12-24(32)27(40-2)14-26(22)41-31(39)23(18)13-28(35)33-15-19-8-10-21(11-9-19)29(36)34-25(30(37)38)17-42-16-20-6-4-3-5-7-20/h3-7,12,14,19,21,25H,8-11,13,15-17H2,1-2H3,(H,33,35)(H,34,36)(H,37,38)/t19-,21-,25-/m1/s1
InChIKey
WYTCOIHWOFTECU-DZRGJMJISA-N
Synonyms

(S)3(benzylthio)2((1r4S)4((2(6chloro7methoxy4methyl2oxo2Hchromen3yl)acetamido)methyl)cyclohexanecarboxamido)propanoicacid
COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)NC(C@@H)1CC(C@H)(CC1)C(=O)N(C@@H)(C(=O)O)CSCc1ccccc1
MFCD18245528
SbenzylN((trans4((((6chloro7methoxy4methyl2oxo2Hchromen3yl)acetyl)amino)methyl)cyclohexyl)carbonyl)Dcysteine
ZINC000245329030

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Available files

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