Vitas-M small molecule compound
4-(2-methylpropyl)-1,5-dioxo-N-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide
Catalog ID
STK943689
SMILES CCCc1n[nH]/c(=N/C(=O)C23CCC(=O)N3c3c(C(=O)N2CC(C)C)cccc3)/s1
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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 C21H25N5O3S MW 427.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O3S/c1-4-7-16-23-24-20(30-16)22-19(29)21-11-10-17(27)26(21)15-9-6-5-8-14(15)18(28)25(21)12-13(2)3/h5-6,8-9,13H,4,7,10-12H2,1-3H3,(H,22,24,29)InChIKey
IVOMEKPLPNMSRK-UHFFFAOYSA-NSynonyms
1236264-01-91236264019
4(2methylpropyl)15dioxoN((2Z)5propyl134thiadiazol2(3H)ylidene)2345tetrahydropyrrolo(12a)quinazoline3a(1H)carboxamide
4(2methylpropyl)15dioxoN(5propyl134thiadiazol2yl)23dihydropyrrolo(12a)quinazoline3acarboxamide
CCCC1=NN=C(S1)NC(=O)C23CCC(=O)N2C4=CC=CC=C4C(=O)N3CC(C)C
CCCc1n(nH)c(=NC(=O)C23CCC(=O)N3c3c(C(=O)N2CC(C)C)cccc3)s1
InChI=1SC21H25N5O3Sc14716232420(3016)2219(29)21111017(27)26(21)15965814(15)18(28)25(21)1213(2)3h568913H471012H213H3(H222429)
MFCD18180465
ZINC000040286943
ZINC000040286944
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