Vitas-M small molecule compound
2-{[3-(3-methylphenyl)-4-oxo-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Catalog ID
STK720577
SMILES O=C(Nc1cccc2c1cccc2)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C
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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 C31H29N3O3S2 MW 555.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O3S2/c1-18(2)25-15-23-26(16-37-25)39-29-28(23)30(36)34(21-11-6-8-19(3)14-21)31(33-29)38-17-27(35)32-24-13-7-10-20-9-4-5-12-22(20)24/h4-14,18,25H,15-17H2,1-3H3,(H,32,35)InChIKey
ZDOPOFQTMQNCPP-UHFFFAOYSA-NSynonyms
2((3(3methylphenyl)4oxo6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)N(naphthalen1yl)acetamide
2((3(3methylphenyl)4oxo6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)Nnaphthalen1ylacetamide
2((6isopropyl4oxo3(mtolyl)4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)N(naphthalen1yl)acetamide
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=CC5=CC=CC=C54)SC6=C3CC(OC6)C(C)C
InChI=1SC31H29N3O3S2c118(2)25152326(163725)392928(23)30(36)34(21116819(3)1421)31(3329)381727(35)322413710209451222(20)24h4141825H1517H213H3(H3235)
MFCD03684700
ZINC000002555033
ZINC000002555036
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