Vitas-M small molecule compound
2'-(butan-2-yl)-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Catalog ID
STL237937
SMILES COCc1nnc(s1)NC(=O)C1c2ccccc2C(=O)N(C21CCCCC2)C(CC)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 C23H30N4O3S MW 442.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4O3S/c1-4-15(2)27-21(29)17-11-7-6-10-16(17)19(23(27)12-8-5-9-13-23)20(28)24-22-26-25-18(31-22)14-30-3/h6-7,10-11,15,19H,4-5,8-9,12-14H2,1-3H3,(H,24,26,28)InChIKey
AWCFKMVWHISPBG-UHFFFAOYSA-NSynonyms
1323954-78-41323954784
2(BUTAN2YL)N((2E)5(METHOXYMETHYL)134THIADIAZOL2(3H)YLIDENE)1OXO14DIHYDRO2HSPIRO(CYCLOHEXANE13ISOQUINOLINE)4CARBOXAMIDE
2(BUTAN2YL)N(5(METHOXYMETHYL)134THIADIAZOL2YL)1OXO14DIHYDRO2HSPIRO(CYCLOHEXANE13ISOQUINOLINE)4CARBOXAMIDE
2(secbutyl)N(5(methoxymethyl)134thiadiazol2yl)1oxo24dihydro1Hspiro(cyclohexane13isoquinoline)4carboxamide
2butan2ylN(5(methoxymethyl)134thiadiazol2yl)1oxospiro(4Hisoquinoline31cyclohexane)4carboxamide
CCC(C)N1C(=O)C2=CC=CC=C2C(C13CCCCC3)C(=O)NC4=NN=C(S4)COC
InChI=1SC23H30N4O3Sc1415(2)2721(29)1711761016(17)19(23(27)128591323)20(28)2422262518(3122)14303h6710111519H45891214H213H3(H242628)
MFCD24858775
ZINC000071288603
ZINC000071288609
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