Vitas-M small molecule compound

N-[(7S)-10-{[2-(8-chloro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-2-oxoethyl]amino}-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide

Catalog ID
STL547975
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCC(=O)N2CCc3c(C2)c2cc(Cl)ccc2[nH]3)NC(=O)C)cc(c1OC)OC

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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 C34H35ClN4O6 MW 631.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H35ClN4O6/c1-18(40)37-25-8-5-19-13-30(43-2)33(44-3)34(45-4)32(19)21-7-10-28(29(41)15-23(21)25)36-16-31(42)39-12-11-27-24(17-39)22-14-20(35)6-9-26(22)38-27/h6-7,9-10,13-15,25,38H,5,8,11-12,16-17H2,1-4H3,(H,36,41)(H,37,40)/t25-/m0/s1
InChIKey
DSRNJJDZOMPOQK-VWLOTQADSA-N
Synonyms

(S)N(10((2(8chloro34dihydro1Hpyrido(43b)indol2(5H)yl)2oxoethyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
~(N)((7~(S))10((2(8chloro1345tetrahydropyrido(43b)indol2yl)2oxoethyl)amino)123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
121541254
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCC(=O)N2CCc3c(C2)c2cc(Cl)ccc2(nH)3)NC(=O)C)cc(c1OC)OC
InChI=1SC34H35ClN4O6c118(40)372585191330(432)33(443)34(454)32(19)2171028(29(41)1523(21)25)361631(42)3912112724(1739)221420(35)6926(22)3827h6791013152538H5811121617H214H3(H3641)(H3740)t25m0s1
N((7S)10((2(8chloro1345tetrahydro2Hpyrido(43b)indol2yl)2oxoethyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000263585066
ZINC263585066

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Available files

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