Vitas-M small molecule compound

2-[(4-chlorobenzyl)sulfanyl]-3-(2-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

Catalog ID
STK538774
SMILES Clc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3

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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 C31H29ClN2OS MW 513.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29ClN2OS/c1-21-9-3-6-12-26(21)34-29(35)27-28(33-30(34)36-20-22-13-15-24(32)16-14-22)25-11-5-4-10-23(25)19-31(27)17-7-2-8-18-31/h3-6,9-16H,2,7-8,17-20H2,1H3
InChIKey
ISCGEADFZJJVFE-UHFFFAOYSA-N
Synonyms
383899-80-7
2((4chlorobenzyl)sulfanyl)3(2methylphenyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((4chlorobenzyl)thio)3(otolyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((4CHLOROPHENYL)METHYLSULFANYL)3(2METHYLPHENYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
383899807
CC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC6=CC=C(C=C6)Cl
InChI=1SC31H29ClN2OSc1219361226(21)3429(35)2728(3330(34)362022131524(32)161422)2511541023(25)1931(27)177281831h36916H2781720H21H3
MFCD03283814
ZINC000002316831
ZINC02316831
ZINC2316831

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Available files

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