Vitas-M small molecule compound
2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Catalog ID
STK544294
SMILES COc1ccc(cc1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)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 C31H31N3O4S MW 541.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O4S/c1-37-23-13-11-22(12-14-23)32-26(35)20-39-30-33-28-25-10-4-3-8-21(25)18-31(15-5-2-6-16-31)27(28)29(36)34(30)19-24-9-7-17-38-24/h3-4,7-14,17H,2,5-6,15-16,18-20H2,1H3,(H,32,35)InChIKey
WBDHIWRXRKWGQP-UHFFFAOYSA-NSynonyms
499208-50-32((3(furan2ylmethyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(4methoxyphenyl)acetamide
2((3(furan2ylmethyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(4methoxyphenyl)acetamide
2(3(FURAN2YLMETHYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLN(4METHOXYPHENYL)ACETAMIDE
499208503
COC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CO4)C5(CCCCC5)CC6=CC=CC=C63
InChI=1SC31H31N3O4Sc13723131122(121423)3226(35)2039303328251043821(25)1831(155261631)27(28)29(36)34(30)192497173824h3471417H25615161820H21H3(H3235)
MFCD03303540
ZINC000001288619
ZINC01288619
ZINC1288619
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