Vitas-M small molecule compound
N-(2-methylphenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Catalog ID
STK539262
SMILES C=CCn1c(SCC(=O)Nc2ccccc2C)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 C29H31N3O2S MW 485.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O2S/c1-3-17-32-27(34)25-26(22-13-7-6-12-21(22)18-29(25)15-9-4-10-16-29)31-28(32)35-19-24(33)30-23-14-8-5-11-20(23)2/h3,5-8,11-14H,1,4,9-10,15-19H2,2H3,(H,30,33)InChIKey
PRNJFJOQDBKRGK-UHFFFAOYSA-NSynonyms
371119-54-92((3allyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(otolyl)acetamide
371119549
CC1=CC=CC=C1NC(=O)CSC2=NC3=C(C(=O)N2CC=C)C4(CCCCC4)CC5=CC=CC=C53
InChI=1SC29H31N3O2Sc13173227(34)2526(2213761221(22)1829(25)1594101629)3128(32)351924(33)302314851120(23)2h3581114H149101519H22H3(H3033)
MFCD03007750
N(2methylphenyl)2((4oxo3(prop2en1yl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
N(2METHYLPHENYL)2(4OXO3PROP2ENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000001797161
ZINC01797161
ZINC1797161
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