Vitas-M small molecule compound

2-{[3-(3-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N,N-diphenylacetamide

Catalog ID
STK544507
SMILES Cc1cccc(c1)n1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

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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 C38H35N3O2S MW 597.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H35N3O2S/c1-27-14-13-20-31(24-27)41-36(43)34-35(32-21-10-9-15-28(32)25-38(34)22-11-4-12-23-38)39-37(41)44-26-33(42)40(29-16-5-2-6-17-29)30-18-7-3-8-19-30/h2-3,5-10,13-21,24H,4,11-12,22-23,25-26H2,1H3
InChIKey
WHNOPYHHOCBALZ-UHFFFAOYSA-N
Synonyms

2((3(3methylphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)NNdiphenylacetamide
2((4oxo3(mtolyl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)NNdiphenylacetamide
2(3(3METHYLPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLNNDIPHENYLACETAMIDE
CC1=CC(=CC=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)N(C6=CC=CC=C6)C7=CC=CC=C7
InChI=1SC38H35N3O2Sc12714132031(2427)4136(43)3435(32211091528(32)2538(34)22114122338)3937(41)442633(42)40(29165261729)30187381930h23510132124H4111222232526H21H3
MFCD03299730
ZINC000001829410
ZINC01829410
ZINC1829410

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Available files

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