Vitas-M small molecule compound

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

Catalog ID
STK555441
SMILES O=C(Nc1cccc(c1C)Cl)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(C)C)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 C30H34ClN3O2S MW 536.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34ClN3O2S/c1-19(2)17-34-28(36)26-27(22-11-6-5-10-21(22)16-30(26)14-7-4-8-15-30)33-29(34)37-18-25(35)32-24-13-9-12-23(31)20(24)3/h5-6,9-13,19H,4,7-8,14-18H2,1-3H3,(H,32,35)
InChIKey
AWJOAJPDIHUJDL-UHFFFAOYSA-N
Synonyms
841206-64-2
841206642
CC1=C(C=CC=C1Cl)NC(=O)CSC2=NC3=C(C(=O)N2CC(C)C)C4(CCCCC4)CC5=CC=CC=C53
InChI=1SC30H34ClN3O2Sc119(2)173428(36)2627(2211651021(22)1630(26)147481530)3329(34)371825(35)32241391223(31)20(24)3h5691319H4781418H213H3(H3235)
MFCD04011182
N(3chloro2methylphenyl)2((3(2methylpropyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
N(3chloro2methylphenyl)2((3isobutyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
N(3CHLORO2METHYLPHENYL)2(3(2METHYLPROPYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000002373825
ZINC2373825

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Available files

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