Vitas-M small molecule compound

N-({2-[(11aS)-5-(3-chlorophenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]phenyl}carbonyl)-D-leucine

Catalog ID
STL530717
SMILES CC(C[C@H](C(=O)O)NC(=O)c1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1cccc(c1)Cl)c1c(C2)c2ccccc2[nH]1)C

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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 C32H29ClN4O5 MW 585.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29ClN4O5/c1-17(2)14-24(31(40)41)35-29(38)21-11-4-6-13-25(21)37-30(39)26-16-22-20-10-3-5-12-23(20)34-27(22)28(36(26)32(37)42)18-8-7-9-19(33)15-18/h3-13,15,17,24,26,28,34H,14,16H2,1-2H3,(H,35,38)(H,40,41)/t24-,26+,28?/m1/s1
InChIKey
BNTKYZQOQCVLRD-MAKPOSLASA-N
Synonyms
956960-74-0
(2~(R))2((2((15~(S))10(3chlorophenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzoyl)amino)4methylpentanoicacid
(2S)2(2((11aS)5(3chlorophenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamido)4methylpentanoicacid
16406159
956960740
CC(C(C@@H)(C(=O)O)NC(=O)c1ccccc1N1C(=O)(C@H)2N(C1=O)C(c1cccc(c1)Cl)c1c(C2)c2ccccc2(nH)1)C
InChI=1SC32H29ClN4O5c117(2)1424(31(40)41)3529(38)2111461325(21)3730(39)2616222010351223(20)3427(22)28(36(26)32(37)42)1887919(33)1518h313151724262834H1416H212H3(H3538)(H4041)t2426+28?m1s1
N((2((11aS)5(3chlorophenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)phenyl)carbonyl)Dleucine
ZINC000070707060
ZINC000070707063

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Available files

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