Vitas-M small molecule compound
12-(1-benzyl-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-6-yl)-3,4,5,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1(2H)-one
Catalog ID
STL436217
SMILES O=C1CCCC2=C1C(c1ccc3c(c1)C(C)CC(N3Cc1ccccc1)(C)C)n1c(N2)nc2c1cccc2
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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 C33H34N4O MW 502.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H34N4O/c1-21-19-33(2,3)36(20-22-10-5-4-6-11-22)27-17-16-23(18-24(21)27)31-30-26(13-9-15-29(30)38)35-32-34-25-12-7-8-14-28(25)37(31)32/h4-8,10-12,14,16-18,21,31H,9,13,15,19-20H2,1-3H3,(H,34,35)InChIKey
MQAFQLQGIRXNRR-UHFFFAOYSA-NSynonyms
12(1benzyl224trimethyl1234tetrahydroquinolin6yl)34512tetrahydrobenzimidazo(21b)quinazolin1(2H)one
12(1benzyl224trimethyl34dihydroquinolin6yl)34512tetrahydro2Hbenzimidazolo(21b)quinazolin1one
CC1CC(N(C2=C1C=C(C=C2)C3C4=C(CCCC4=O)NC5=NC6=CC=CC=C6N35)CC7=CC=CC=C7)(C)C
InChI=1SC33H34N4Oc1211933(23)36(2022105461122)27171623(1824(21)27)313026(1391529(30)38)3532342512781428(25)37(31)32h4810121416182131H913151920H213H3(H3435)
MFCD30711903
ZINC000226073861
ZINC000230144238
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