Vitas-M small molecule compound
2-{[4-oxo-3-(2-phenylethyl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N,N-diphenylpropanamide
Catalog ID
STL441049
SMILES CC(C(=O)N(c1ccccc1)c1ccccc1)Sc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)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 C40H39N3O2S MW 625.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H39N3O2S/c1-29(37(44)43(32-19-8-3-9-20-32)33-21-10-4-11-22-33)46-39-41-36-34-23-13-12-18-31(34)28-40(25-14-5-15-26-40)35(36)38(45)42(39)27-24-30-16-6-2-7-17-30/h2-4,6-13,16-23,29H,5,14-15,24-28H2,1H3InChIKey
FECCILKWIYYIIJ-UHFFFAOYSA-NSynonyms
2((4oxo3(2phenylethyl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)NNdiphenylpropanamide
2(4oxo3(2phenylethyl)spiro(6Hbenzo(h)quinazoline51cyclohexane)2yl)sulfanylNNdiphenylpropanamide
2(4OXO3PHENETHYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLNNDIPHENYLPROPANAMIDE
CC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NC4=C(C(=O)N3CCC5=CC=CC=C5)C6(CCCCC6)CC7=CC=CC=C74
InChI=1SC40H39N3O2Sc129(37(44)43(32198392032)3321104112233)46394136342313121831(34)2840(25145152640)35(36)38(45)42(39)272430166271730h24613162329H514152428H21H3
MFCD06243774
ZINC000008769648
ZINC000008769653
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