Vitas-M small molecule compound

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

Catalog ID
STK545319
SMILES Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCC3

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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 C31H30N2OS MW 478.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N2OS/c1-21-13-15-23(16-14-21)20-35-30-32-28-25-11-5-4-10-24(25)19-31(17-7-8-18-31)27(28)29(34)33(30)26-12-6-3-9-22(26)2/h3-6,9-16H,7-8,17-20H2,1-2H3
InChIKey
VYOQJUHWWOLZIU-UHFFFAOYSA-N
Synonyms
488708-32-3
2((4methylbenzyl)sulfanyl)3(2methylphenyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2((4methylbenzyl)thio)3(otolyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(2METHYLPHENYL)2((4METHYLPHENYL)METHYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
488708323
CC1=CC=C(C=C1)CSC2=NC3=C(C(=O)N2C4=CC=CC=C4C)C5(CCCC5)CC6=CC=CC=C63
InChI=1SC31H30N2OSc121131523(161421)20353032282511541024(25)1931(17781831)27(28)29(34)33(30)261263922(26)2h36916H781720H212H3
MFCD03290701
ZINC000002335803
ZINC02335803
ZINC2335803

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Available files

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