Vitas-M small molecule compound
N-(3-chloro-4-methoxyphenyl)-2-{[4-oxo-3-(2-phenylethyl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Catalog ID
STL441021
SMILES COc1ccc(cc1Cl)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)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 C33H32ClN3O3S MW 586.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32ClN3O3S/c1-40-27-14-13-24(19-26(27)34)35-28(38)21-41-32-36-30-25-12-6-5-11-23(25)20-33(16-7-8-17-33)29(30)31(39)37(32)18-15-22-9-3-2-4-10-22/h2-6,9-14,19H,7-8,15-18,20-21H2,1H3,(H,35,38)InChIKey
GXIFETNOWYWILQ-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)C5(CCCC5)CC6=CC=CC=C63)Cl
InChI=1SC33H32ClN3O3Sc14027141324(1926(27)34)3528(38)21413236302512651123(25)2033(16781733)29(30)31(39)37(32)18152293241022h2691419H7815182021H21H3(H3538)
MFCD06243750
N(3chloro4methoxyphenyl)2((4oxo3(2phenylethyl)46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)acetamide
N(3chloro4methoxyphenyl)2(4oxo3(2phenylethyl)spiro(6Hbenzo(h)quinazoline51cyclopentane)2yl)sulfanylacetamide
N(3CHLORO4METHOXYPHENYL)2(4OXO3PHENETHYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLACETAMIDE
ZINC000003771685
ZINC3771685
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